Registration Dossier

Data platform availability banner - registered substances factsheets

Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Environmental fate & pathways

Hydrolysis

Currently viewing:

Administrative data

Link to relevant study record(s)

Reference
Endpoint:
hydrolysis
Type of information:
experimental study
Adequacy of study:
key study
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
guideline study
Qualifier:
according to guideline
Guideline:
OECD Guideline 111 (Hydrolysis as a Function of pH)
GLP compliance:
yes (incl. QA statement)
Specific details on test material used for the study:
STABILITY AND STORAGE CONDITIONS OF TEST MATERIAL
- Storage condition of test material:
Ambient(21 to 29℃)
- Solubility and stability of the test material in the solvent/vehicle and the exposure medium:
soluble and stable


TREATMENT OF TEST MATERIAL PRIOR TO TESTING
- Treatment of test material prior to testing (e.g. warming, grinding):
no
- Preliminary purification step (if any):
- Final concentration of a dissolved solid, stock liquid or gel:
not specified
Radiolabelling:
no
Analytical monitoring:
yes
Remarks:
HPLC
Details on sampling:
- Sampling intervals for the parent/transformation products:
- Sampling method:
A duplicate sample of each pH buffers were taken immediately after the addition of the test item on 0 hour (pH 4.0, pH 7.0 and pH 9.0) and incubated at 15± 0.5ºC, 25 ± 0.5ºC and 50 ± 0.5ºC.
All the test samples were analyzed for active content concentration at each occasion as follows.
For 50ºC: 0th hour, 4th hour, 8th hour, 12th hour, 20th hour, 24th hour, 30th hour,48th hour (day 2), 72nd hour (day 3) for all three pH buffers.
For 25ºC: 0th hour, 4th hour, 8th hour, 12th hour, 20th hour, 24th hour, 30th hour, 48th hour (day 2), 72nd hour (day3), 144th hour (day 6), 192nd hour (day 8), 264th hour (day 11), 360th hour (day 15) for all three pH buffers.
For 15ºC: 0th hour, 4th hour, 8th hour, 12th hour, 20th hour, 24th hour (day 1), 30th hour, 48th hour (day 2), 72nd hour (day 3), 144th hour (day 6), 360th hour (day 15), 528th hour (day 22), 720th hour (day 30) for all three pH buffers.
Buffers:
- Type and final molarity of buffer:
- Composition of buffer:
Buffer Solution of pH 4: An aliquot of 12.0 mL of 0.1 N sodium hydroxide solution and 1500.0 mL of 0.1 M potassium biphthalate solution was diluted to 3000 mL with Milli-Q water. The pH of the resulting buffer solution was found to be 3.96 and then pH of buffer solution was adjusted to 4.00 using 0.1 N sodium hydroxide solution.

Buffer Solution of pH 7: An aliquot of 889.90 mL of 0.1 N sodium hydroxide solution and 1500.0 mL of 0.1 M potassium phosphate solution was diluted to 3000 mL with Milli-Q water. The pH of the resulting buffer solution was found to be 6.97 and then pH of buffer solution was adjusted to 7.00 using 0.1 N sodium hydroxide solution.

Buffer Solution of pH 9: An aliquot of 639.0 mL of 0.1 N sodium hydroxide solution and 1500.0 mL of 0.1 M boric acid solution was diluted to 3000 mL with Milli-Q water. The pH of the resulting buffer solution was found to be 8.95 and then pH of buffer solution was adjusted to 9.00 using 0.1 N sodium hydroxide solution.
Details on test conditions:
TEST SYSTEM
- Type, material and volume of test flasks, other equipment used:
50ml amber coloured glass bottle
- Sterilisation method:
The glassware (before use) and prepared buffer solutions were sterilized by autoclaving at 121.0°C for about 15 minutes and filtered passing through 0.2 µm sterilized filter and oxygen in the solutions was excluded by sonication for five minutes.
- Light:
dark

TEST MEDIUM
- Volume used/treatment
10 ml
- Kind and purity of water:
Milli-Q water
- Preparation of test medium:
The prepared test item solutions in each pH 4.0, 7.0 and 9.0 buffers was maintained at temperature of 50 ± 0.5°C for a period of 5 days duration of the study and it was continuously monitored and recorded during preliminary test in all working days (once in a day) throughout the course of the study.
- Renewal of test solution:
no
Duration:
30 d
pH:
4
Temp.:
15 °C
Initial conc. measured:
9.37 mg/L
Duration:
15 d
pH:
4
Temp.:
25 °C
Initial conc. measured:
9.37 mg/L
Duration:
3 d
pH:
4
Temp.:
50 °C
Initial conc. measured:
9.37 mg/L
Duration:
30 d
pH:
7
Temp.:
15 °C
Initial conc. measured:
9.3 mg/L
Duration:
15 d
pH:
7
Temp.:
25 °C
Initial conc. measured:
9.3 mg/L
Duration:
3 d
pH:
7
Temp.:
50 °C
Initial conc. measured:
9.3 mg/L
Duration:
30 d
pH:
9
Temp.:
15 °C
Initial conc. measured:
9.38 mg/L
Duration:
15 d
pH:
9
Temp.:
25 °C
Initial conc. measured:
9.38 mg/L
Duration:
3 d
pH:
9
Temp.:
50 °C
Initial conc. measured:
9.38 mg/L
Number of replicates:
duplicate for each occasion
Positive controls:
no
Negative controls:
no
Preliminary study:
The rate of hydrolysis at 50 ± 0.5ºC was assessed for pH 4, pH 7 and pH 9. The percent degradation of the test item were found to be100% at each pH 4, pH 7 and pH 9 buffers over a period of 5 days of incubation. Hence, the test item was hydrolytically unstable in pH 4, pH 7 and pH 9 at 50 ± 0.5ºC after 5 days.
Based on the preliminary test results, the test item 1,3-Propene Sultone was hydrolytically unstable in pH 4, pH 7 and pH 9 at 50°C.
Transformation products:
no
Remarks:
From the Tier 2 results, the HPLC chromatograms of the test item in 3 pH buffers solutions incubated at 3 temperatures evidenced that there were no peaks identified other than the test item and diluent peaks. There is no formation of hydrolyzed product.
pH:
4
Temp.:
15 °C
Hydrolysis rate constant:
0.002 h-1
DT50:
288.75 h
Type:
(pseudo-)first order (= half-life)
pH:
4
Temp.:
25 °C
Hydrolysis rate constant:
0.007 h-1
DT50:
97.61 h
Type:
(pseudo-)first order (= half-life)
pH:
4
Temp.:
50 °C
Hydrolysis rate constant:
0.07 h-1
DT50:
9.96 h
Type:
(pseudo-)first order (= half-life)
pH:
7
Temp.:
15 °C
Hydrolysis rate constant:
0.003 h-1
DT50:
266.54 h
Type:
(pseudo-)first order (= half-life)
pH:
7
Temp.:
25 °C
Hydrolysis rate constant:
0.007 h-1
DT50:
92.4 h
Type:
(pseudo-)first order (= half-life)
pH:
7
Temp.:
50 °C
Hydrolysis rate constant:
0.007 h-1
DT50:
9.9 h
Type:
(pseudo-)first order (= half-life)
pH:
9
Temp.:
15 °C
Hydrolysis rate constant:
0.002 h-1
DT50:
301.3 h
Type:
(pseudo-)first order (= half-life)
pH:
9
Temp.:
25 °C
Hydrolysis rate constant:
0.007 h-1
DT50:
103.43 h
Type:
(pseudo-)first order (= half-life)
pH:
9
Temp.:
50 °C
Hydrolysis rate constant:
0.071 h-1
DT50:
9.71 h
Type:
(pseudo-)first order (= half-life)
Details on results:
TEST CONDITIONS
- pH, sterility, temperature, and other experimental conditions maintained throughout the study: Yes


MAJOR TRANSFORMATION PRODUCTS
No transformation products

MINOR TRANSFORMATION PRODUCTS
No transformation products

INDICATION OF UNSTABLE TRANSFORMATION PRODUCTS:
No transformation products

VOLATILIZATION (at end of study)
No volatilization

UNIDENTIFIED RADIOACTIVITY (at end of study)
No radioactivity identified

TABLE 1.     SPECIFICITY

Sample Code

LOQ Area (mAU)

Sample Area (mAU)

% Interference

Diluent 1

69319

6561

9.47

Diluent pH 4

69319

763

1.10

Diluent pH 7

69319

1185

1.71

Diluent pH 9

69319

526

0.76

 

Interference (%)

=

Sample Area × 100

LOQArea

TABLE 2.     LIMIT OF DETECTION (LOD) AND LIMIT OF QUANTIFICATION (LOQ)

Sample Code

LDQSample Conc. (mg/L)

Sample Peak Area(mAU)

Diluent Peak Area(mAU)

Signal to Noise Ratio

Identification

LDQ 1

19.9200

1452600

6561

221.40

-

LDQ 2

9.9600

719169

109.61

-

LDQ 3

4.9800

360266

54.91

-

LDQ 4

1.9920

161513

24.62

-

LDQ 5

0.9960

69319

10.57

LOQ

LDQ 6

0.4980

35021

5.34

-

LDQ 7

0.1992

22903

3.49

LOD

LDQ 8

0.0996

17689

2.70

-

LDQ 9

0.0498

2818

0.43

-

 Diluent :Acetonitrile

 Signal to Noise Ratio

=

Sample Peak Area

Diluent Peak Area

TABLE 3.     LINEARITY CALCULATIONS(DATE OF ANALYSIS: 13/07/2020)

Concentration (mg/L)

Peak Area (mAU)

0.5015

31034

1.0030

68435

2.5075

183408

5.0150

347766

10.0300

693261

12.5375

874745

Intercept

257.79

Slope

69540.66

Correlation Coefficient (r)

0.9999

     TABLE 4.     LINEARITY CALCULATIONS (DATE OF ANALYSIS: 14/07/2020)

Concentration (mg/L)

Peak Area (mAU)

0.5005

27476

1.0010

68907

2.5025

165564

5.0050

347909

10.0100

699716

12.5125

875217

Intercept

-6222.98

Slope

70473.24

Correlation Coefficient (r)

1.0000

 

TABLE 5.     LINEARITY CALCULATIONS (DATE OF ANALYSIS: 08/12/2020)

Standard Concentration (mg/L)

Peak Area (mAU)

0.5050

21914

1.0100

69299

2.5250

152620

5.0500

291470

10.1000

559332

12.6250

680070

Intercept

10841.62

Slope

53737.40

Correlation Coefficient (r)

0.9993

TABLE 6.     DETERMINATION OFACCURACY AND PRECISION OF TEST ITEM INpH 4.0 BUFFER SOLUTIONS

Sample Code

Peak Area (mAU)

Slope

Intercept

Dilution Factor

NominalConc. (mg/L)

Obtained Conc. (mg/L)

Recovery (%)

Mean (%) Recovery

Mean Conc. (mg/L)

SD (±)

RSD (%)

Control 1 pH 4

BLOQ

69540.66

257.79

1

-

-

-

-

-

-

-

Accuracy 1 R1 pH 4

71798

69540.66

257.79

1

0.9974

1.0288

103.15

104.57

1.0430

2.83

2.71

Accuracy 1 R2 pH 4

71810

69540.66

257.79

1

0.9974

1.0289

103.16

Accuracy 1 R3 pH 4

70626

69540.66

257.79

1

0.9974

1.0119

101.45

Accuracy 1 R4 pH 4

74446

69540.66

257.79

1

0.9974

1.0668

106.96

Accuracy 1 R5 pH 4

75255

69540.66

257.79

1

0.9974

1.0785

108.13

Control 2 pH 4

BLOQ

69540.66

257.79

1

-

-

-

-

-

-

-

Accuracy 2 R1 pH 4

706695

69540.66

257.79

1

9.9740

10.1586

101.85

100.86

10.0594

0.71

0.70

Accuracy 2 R2 pH 4

700150

69540.66

257.79

1

9.9740

10.0645

100.91

Accuracy 2 R3 pH 4

697208

69540.66

257.79

1

9.9740

10.0222

100.48

Accuracy 2 R4 pH 4

701491

69540.66

257.79

1

9.9740

10.0838

101.10

Accuracy 2 R5 pH 4

693418

69540.66

257.79

1

9.9740

9.9677

99.94

 TABLE 7.     DETERMINATION OFACCURACY AND PRECISION OF TEST ITEM INpH 7.0 BUFFER SOLUTIONS

Sample Code

Peak Area (mAU)

Slope

Intercept

Dilution Factor

NominalConc. (mg/L)

Obtained Conc. (mg/L)

Recovery (%)

Mean (%) Recovery

Mean Conc. (mg/L)

SD (±)

RSD (%)

Control 1 pH 7

BLOQ

69540.66

257.79

1

-

-

-

-

-

-

-

Accuracy 1 R1 pH 7

74997

69540.66

257.79

1

1.0034

1.0748

107.12

104.02

1.0438

4.14

3.98

Accuracy 1 R2 pH 7

76718

69540.66

257.79

1

1.0034

1.0995

109.58

Accuracy 1 R3 pH 7

69824

69540.66

257.79

1

1.0034

1.0004

99.70

Accuracy 1 R4 pH 7

71329

69540.66

257.79

1

1.0034

1.0220

101.85

Accuracy 1 R5 pH 7

71339

69540.66

257.79

1

1.0034

1.0222

101.87

Control 2 pH 7

BLOQ

69540.66

257.79

1

-

-

-

-

-

-

Accuracy 2 R1 pH 7

687693

69540.66

257.79

1

10.0340

9.8854

98.52

98.90

9.9239

0.51

0.52

Accuracy 2 R2 pH 7

688958

69540.66

257.79

1

10.0340

9.9036

98.70

Accuracy 2 R3 pH 7

687594

69540.66

257.79

1

10.0340

9.8839

98.50

Accuracy 2 R4 pH 7

691446

69540.66

257.79

1

10.0340

9.9393

99.06

Accuracy 2 R5 pH 7

696172

69540.66

257.79

1

10.0340

10.0073

99.73

  TABLE 8.     DETERMINATION OFACCURACY AND PRECISIONOF TEST ITEM INpH 9.0 BUFFER SOLUTIONS

Sample Code

Peak Area (mAU)

Slope

Intercept

Dilution Factor

NominalConc. (mg/L)

Obtained Conc. (mg/L)

Recovery (%)

Mean (%) Recovery

Mean Conc. (mg/L)

SD (±)

RSD (%)

Control 1 pH 9

BLOQ

70473.24

-6222.98

1

-

-

-

-

-

-

-

Accuracy 1 R1 pH 9

67984

70473.24

-6222.98

1

1.0038

1.0530

104.90

97.63

0.9800

5.82

5.96

Accuracy 1 R2 pH 9

57584

70473.24

-6222.98

1

1.0038

0.9054

90.20

Accuracy 1 R3 pH 9

60163

70473.24

-6222.98

1

1.0038

0.9420

93.84

Accuracy 1 R4 pH 9

65380

70473.24

-6222.98

1

1.0038

1.0160

101.22

Accuracy 1 R5 pH 9

63093

70473.24

-6222.98

1

1.0038

0.9836

97.99

Control 2 pH 9

BLOQ

70473.24

-6222.98

1

-

-

-

 -

-

-

-

Accuracy 2 R1 pH 9

694703

70473.24

-6222.98

1

10.0380

9.9460

99.08

97.86

9.8234

2.24

2.29

Accuracy 2 R2 pH 9

698757

70473.24

-6222.98

1

10.0380

10.0035

99.66

Accuracy 2 R3 pH 9

688214

70473.24

-6222.98

1

10.0380

9.8539

98.17

Accuracy 2 R4 pH 9

689955

70473.24

-6222.98

1

10.0380

9.8786

98.41

Accuracy 2 R5 pH 9

658694

70473.24

-6222.98

1

10.0380

9.4350

93.99

 TABLE 1.     CONCENTRATION OF1, 3-PROPENE SULTONEIN pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS ON DAY 0 AT 50°C-TIER 1 TEST

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4

BLOQ

346046

-

-

-

 

Sample pH 4 R1 Rep 1

361514

5.0050

2.0

10.46

10.43

Sample pH 4 R1 Rep 2

358344

5.0050

2.0

10.37

Sample pH 4 R2 Rep 1

359750

5.0050

2.0

10.41

Sample pH 4 R2 Rep 2

361685

5.0050

2.0

10.46

Control pH 7

BLOQ

-

-

-

 

Sample pH 7 R1 Rep 1

347613

5.0050

2.0

10.06

10.11

Sample pH 7 R1 Rep 2

349003

5.0050

2.0

10.10

Sample pH 7 R2 Rep 1

349715

5.0050

2.0

10.12

Sample pH 7 R2 Rep 2

350922

5.0050

2.0

10.15

Control pH 9

BLOQ

-

-

-

 

Sample pH 9 R1 Rep 1

350273

5.0050

2.0

10.13

10.05

Sample pH 9 R1 Rep 2

346213

5.0050

2.0

10.01

Sample pH 9 R2 Rep 1

344617

5.0050

2.0

9.97

Sample pH 9 R2 Rep 2

348389

5.0050

2.0

10.08

 TABLE 2.     CONCENTRATION OF1, 3-PROPENE SULTONEIN pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS ON DAY 5 AT 50°C-TIER 1 TEST

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4

BLOQ

317843

-

-

-

-

Sample pH 4 R1 Rep 1

BLOQ

5.0100

2.0

BLOQ

BLOQ

Sample pH 4 R1 Rep 2

BLOQ

5.0100

2.0

BLOQ

Sample pH 4 R2 Rep 1

BLOQ

5.0100

2.0

BLOQ

Sample pH 4 R2 Rep 2

BLOQ

5.0100

2.0

BLOQ

Control pH 7

BLOQ

-

-

-

-

Sample pH 7 R1 Rep 1

BLOQ

5.0100

2.0

BLOQ

BLOQ

Sample pH 7 R1 Rep 2

BLOQ

5.0100

2.0

BLOQ

Sample pH 7 R2 Rep 1

BLOQ

5.0100

2.0

BLOQ

Sample pH 7 R2 Rep 2

BLOQ

5.0100

2.0

BLOQ

Control pH 9

BLOQ

-

-

-

-

Sample pH 9 R1 Rep 1

BLOQ

5.0100

2.0

BLOQ

BLOQ

Sample pH 9 R1 Rep 2

BLOQ

5.0100

2.0

BLOQ

Sample pH 9 R2 Rep 1

BLOQ

5.0100

2.0

BLOQ

Sample pH 9 R2 Rep 2

BLOQ

5.0100

2.0

BLOQ

BLOQ: Below Limit of quantification

 TABLE 3.      PERCENTAGE DEGRADATION OF TEST ITEM CONCENTRATION AFTER 5 DAYS FROM INITIAL ANALYSIS-TIER 1

 

Sample Code

On Day 0, Mean

1, 3-Propene Sultone Concentration (mg/L)

On Day 5, Mean

1, 3-Propene Sultone Concentration (mg/L)

Degradation (%)

Sample pH 4

10.43

BLOQ

100

Sample pH 7

10.11

BLOQ

100

Sample pH 9

10.05

BLOQ

100

            BLOQ: Below Limit of quantification

TABLE 1.     CONCENTRATION OF1, 3-PROPENE SULTONEIN pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 0 HOUR

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 0 hour

BLOQ

298122

-

-

-

-

Sample pH 4 R1 0 hour

276473

5.0500

2.0

9.37

9.37

Sample pH 4 R2 0 hour

276481

5.0500

2.0

9.37

Control pH 7 0 hour

BLOQ

-

-

-

-

Sample pH 7 R1 0 hour

275515

5.0500

2.0

9.33

9.30

Sample pH 7 R2 0 hour

273364

5.0500

2.0

9.26

Control pH 9 0 hour

BLOQ

-

-

-

-

Sample pH 9 R1 0 hour

277751

5.0500

2.0

9.41

9.38

Sample pH 9 R2 0 hour

275898

5.0500

2.0

9.35

TABLE 2.     CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 4thHOUR INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 4 hrs 15D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 4 hrs 15D

274945

5.0500

2.0

9.31

9.33

Sample pH 4 R2 4 hrs 15D

275672

5.0500

2.0

9.34

Control pH 7 4 hrs 15D

BLOQ

-

-

-

-

Sample pH 7 R1 4 hrs 15D

272521

5.0500

2.0

9.23

9.23

Sample pH 7 R2 4 hrs 15D

272408

5.0500

2.0

9.23

Control pH 9 4 hrs 15D

BLOQ

-

-

-

-

Sample pH 9 R1 4 hrs 15D

276583

5.0500

2.0

9.37

9.33

Sample pH 9 R2 4 hrs 15D

274265

5.0500

2.0

9.29

TABLE 3.     CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 4thHOUR INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 4 hrs 25 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 4 hrs 25 D

272958

5.0500

2.0

9.25

9.21

Sample pH 4 R2 4 hrs 25 D

270489

5.0500

2.0

9.16

Control pH 7 4 hrs 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 4 hrs 25 D

269048

5.0500

2.0

9.12

9.13

Sample pH 7 R2 4 hrs 25 D

269842

5.0500

2.0

9.14

Control pH 9 4 hrs 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 4 hrs 25 D

272401

5.0500

2.0

9.23

9.26

Sample pH 9 R2 4 hrs 25 D

274023

5.0500

2.0

9.28

TABLE 4.     CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 4thHOUR INCUBATED AT 50°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 4 hrs 50 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 4 hrs 50 D

235552

5.0500

2.0

7.98

7.95

Sample pH 4 R2 4 hrs 50 D

233917

5.0500

2.0

7.92

Control pH 7 4 hrs 50 D

BLOQ

-

-

-

-

Sample pH 7 R1 4 hrs 50 D

240817

5.0500

2.0

8.16

8.13

Sample pH 7 R2 4 hrs 50 D

238652

5.0500

2.0

8.09

Control pH 9 4 hrs 50 D

BLOQ

-

-

-

-

Sample pH 9 R1 4 hrs 50 D

240595

5.0500

2.0

8.15

8.15

Sample pH 9 R2 4 hrs 50 D

240183

5.0500

2.0

8.14

TABLE 5.     CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 8thHOUR INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 8 hrs 15 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 8 hrs 15 D

270661

5.0500

2.0

9.17

9.19

Sample pH 4 R2 8 hrs 15 D

271627

5.0500

2.0

9.20

Control pH 7 8 hrs 15 D

BLOQ

-

-

-

-

Sample pH 7 R1 8 hrs 15 D

271773

5.0500

2.0

9.21

9.21

Sample pH 7 R2 8 hrs 15 D

271987

5.0500

2.0

9.21

Control pH 9 8 hrs 15 D

BLOQ

-

-

-

-

Sample pH 9 R1 8 hrs 15 D

273084

5.0500

2.0

9.25

9.25

Sample pH 9 R2 8 hrs 15 D

272902

5.0500

2.0

9.25

TABLE 6.     CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 8thHOUR INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 8 hrs 25 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 8 hrs 25 D

258287

5.0500

2.0

8.75

8.79

Sample pH 4 R2 8 hrs 25 D

260302

5.0500

2.0

8.82

Control pH 7 8 hrs 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 8 hrs 25 D

262270

5.0500

2.0

8.89

8.88

Sample pH 7 R2 8 hrs 25 D

261664

5.0500

2.0

8.86

Control pH 9 8 hrs 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 8 hrs 25 D

265632

5.0500

2.0

9.00

9.06

Sample pH 9 R2 8 hrs 25 D

268952

5.0500

2.0

9.11

TABLE 7.     CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 8thHOUR INCUBATED AT 50°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

 Mean Obtained Concentration (mg/L)

Control pH 4 8 hrs 50 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 8 hrs 50 D

212977

5.0500

2.0

7.22

7.27

Sample pH 4 R2 8 hrs 50 D

215816

5.0500

2.0

7.31

Control pH 7 8 hrs 50 D

BLOQ

-

-

-

-

Sample pH 7 R1 8 hrs 50 D

228372

5.0500

2.0

7.74

7.76

Sample pH 7 R2 8 hrs 50 D

229288

5.0500

2.0

7.77

Control pH 9 8 hrs 50 D

BLOQ

-

-

-

-

Sample pH 9 R1 8 hrs 50 D

224798

5.0500

2.0

7.62

7.61

Sample pH 9 R2 8 hrs 50 D

224225

5.0500

2.0

7.60

TABLE 8.     CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 12thHOUR INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 12 hrs 15 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 12 hrs 15 D

267634

5.0500

2.0

9.07

9.09

Sample pH 4 R2 12 hrs 15 D

268690

5.0500

2.0

9.10

Control pH 7 12 hrs 15 D

BLOQ

-

-

-

-

Sample pH 7 R1 12 hrs 15 D

262699

5.0500

2.0

8.90

8.90

Sample pH 7 R2 12 hrs 15 D

262428

5.0500

2.0

8.89

Control pH 9 12 hrs 15 D

BLOQ

-

-

-

-

Sample pH 9 R1 12 hrs 15 D

269245

5.0500

2.0

9.12

9.13

Sample pH 9 R2 12 hrs 15 D

269807

5.0500

2.0

9.14

TABLE 9.     CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 12thHOUR INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 12 hrs 25 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 12 hrs 25 D

250484

5.0500

2.0

8.49

8.59

Sample pH 4 R2 12 hrs 25 D

256608

5.0500

2.0

8.69

Control pH 7 12 hrs 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 12 hrs 25 D

248234

5.0500

2.0

8.41

8.36

Sample pH 7 R2 12 hrs 25 D

245004

5.0500

2.0

8.30

Control pH 9 12 hrs 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 12 hrs 25 D

253219

5.0500

2.0

8.58

8.62

Sample pH 9 R2 12 hrs 25 D

255406

5.0500

2.0

8.65

TABLE 10. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 12thHOUR INCUBATED AT 50°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 12 hrs 50 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 12 hrs 50 D

138825

5.0500

2.0

4.70

4.71

Sample pH 4 R2 12 hrs 50 D

139310

5.0500

2.0

4.72

Control pH 7 12 hrs 50 D

BLOQ

-

-

-

-

Sample pH 7 R1 12 hrs 50 D

109447

5.0500

2.0

3.71

3.70

Sample pH 7 R2 12 hrs 50 D

108532

5.0500

2.0

3.68

Control pH 9 12 hrs 50 D

BLOQ

-

-

-

-

Sample pH 9 R1 12 hrs 50 D

113817

5.0500

2.0

3.86

3.87

Sample pH 9 R2 12 hrs 50 D

114652

5.0500

2.0

3.88

TABLE 11. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 20thHOUR INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 20 hrs 15 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 20 hrs 15 D

265238

5.0500

2.0

8.99

9.02

Sample pH 4 R2 20 hrs 15 D

266911

5.0500

2.0

9.04

Control pH 7 20 hrs 15 D

BLOQ

-

-

-

-

Sample pH 7 R1 20 hrs 15 D

258191

5.0500

2.0

8.75

8.83

Sample pH 7 R2 20 hrs 15 D

262786

5.0500

2.0

8.90

Control pH 9 20 hrs 15 D

BLOQ

-

-

-

-

Sample pH 9 R1 20 hrs 15 D

265542

5.0500

2.0

9.00

8.97

Sample pH 9 R2 20 hrs 15 D

263710

5.0500

2.0

8.93

TABLE 12. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 20thHOUR INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 20 hrs 25 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 20 hrs 25 D

245068

5.0500

2.0

8.30

8.29

Sample pH 4 R2 20 hrs 25 D

244439

5.0500

2.0

8.28

Control pH 7 20 hrs 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 20 hrs 25 D

251930

5.0500

2.0

8.54

8.55

Sample pH 7 R2 20 hrs 25 D

252686

5.0500

2.0

8.56

Control pH 9 20 hrs 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 20 hrs 25 D

248840

5.0500

2.0

8.43

8.45

Sample pH 9 R2 20 hrs 25 D

249657

5.0500

2.0

8.46

TABLE 13. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 20thHOUR INCUBATED AT 50°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 20 hrs 50 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 20 hrs 50 D

38124

5.0500

2.0

1.29

1.28

Sample pH 4 R2 20 hrs 50 D

37445

5.0500

2.0

1.27

Control pH 7 20 hrs 50 D

BLOQ

-

-

-

-

Sample pH 7 R1 20 hrs 50 D

36082

5.0500

2.0

1.22

1.22

Sample pH 7 R2 20 hrs 50 D

35979

5.0500

2.0

1.22

Control pH 9 20 hrs 50 D

BLOQ

-

-

-

-

Sample pH 9 R1 20 hrs 50 D

33517

5.0500

2.0

1.14

1.14

Sample pH 9 R2 20 hrs 50 D

33252

5.0500

2.0

1.13

TABLE 14. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 24thHOUR INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 24 hrs 15 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 24 hrs 15 D

262425

5.0500

2.0

8.89

8.97

Sample pH 4 R2 24 hrs 15 D

266796

5.0500

2.0

9.04

Control pH 7 24 hrs 15 D

BLOQ

-

-

-

-

Sample pH 7 R1 24 hrs 15 D

255572

5.0500

2.0

8.66

8.70

Sample pH 7 R2 24 hrs 15 D

257620

5.0500

2.0

8.73

Control pH 9 24 hrs 15 D

BLOQ

-

-

-

-

Sample pH 9 R1 24 hrs 15 D

261338

5.0500

2.0

8.85

8.88

Sample pH 9 R2 24 hrs 15 D

262856

5.0500

2.0

8.91

TABLE 15. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 24thHOUR INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 24 hrs 25 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 24 hrs 25 D

232292

5.0500

2.0

7.87

7.92

Sample pH 4 R2 24 hrs 25 D

235342

5.0500

2.0

7.97

Control pH 7 24 hrs 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 24 hrs 25 D

217066

5.0500

2.0

7.35

7.47

Sample pH 7 R2 24 hrs 25 D

224133

5.0500

2.0

7.59

Control pH 9 24 hrs 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 24 hrs 25 D

235172

5.0500

2.0

7.97

7.90

Sample pH 9 R2 24 hrs 25 D

231052

5.0500

2.0

7.83

TABLE 16. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 24thHOUR INCUBATED AT 50°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 24 hrs 50 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 24 hrs 50 D

16113

5.0500

2.0

0.55

0.55

Sample pH 4 R2 24 hrs 50 D

16073

5.0500

2.0

0.54

Control pH 7 24 hrs 50 D

BLOQ

-

-

-

-

Sample pH 7 R1 24 hrs 50 D

16974

5.0500

2.0

0.58

0.58

Sample pH 7 R2 24 hrs 50 D

16805

5.0500

2.0

0.57

Control pH 9 24 hrs 50 D

BLOQ

-

-

-

-

Sample pH 9 R1 24 hrs 50 D

16523

5.0500

2.0

0.56

0.57

Sample pH 9 R2 24 hrs 50 D

16732

5.0500

2.0

0.57

TABLE 17. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 30thHOUR INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 30 hrs 15 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 30 hrs 15 D

248272

5.0500

2.0

8.41

8.33

Sample pH 4 R2 30 hrs 15 D

243552

5.0500

2.0

8.25

Control pH 7 30 hrs 15 D

BLOQ

-

-

-

-

Sample pH 7 R1 30 hrs 15 D

245884

5.0500

2.0

8.33

8.38

Sample pH 7 R2 30 hrs 15 D

248707

5.0500

2.0

8.43

Control pH 9 30 hrs 15 D

BLOQ

-

-

-

-

Sample pH 9 R1 30 hrs 15 D

253077

5.0500

2.0

8.57

8.58

Sample pH 9 R2 30 hrs 15 D

253640

5.0500

2.0

8.59

TABLE 18. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 30thHOUR INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 30 hrs 25 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 30 hrs 25 D

205478

5.0500

2.0

6.96

7.03

Sample pH 4 R2 30 hrs 25 D

209595

5.0500

2.0

7.10

Control pH 7 30 hrs 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 30 hrs 25 D

204334

5.0500

2.0

6.92

6.91

Sample pH 7 R2 30 hrs 25 D

203456

5.0500

2.0

6.89

Control pH 9 30 hrs 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 30 hrs 25 D

197928

5.0500

2.0

6.71

6.67

Sample pH 9 R2 30 hrs 25 D

195425

5.0500

2.0

6.62

TABLE 19. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 30thHOUR INCUBATED AT 50°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 30 hrs 50 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 30 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

BLOQ

Sample pH 4 R2 30 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

Control pH 7 30 hrs 50 D

BLOQ

-

-

-

-

Sample pH 7 R1 30 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

BLOQ

Sample pH 7 R2 30 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

Control pH 9 30 hrs 50 D

BLOQ

-

-

-

-

Sample pH 9 R1 30 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

BLOQ

Sample pH 9 R2 30 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

TABLE 20. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 48thHOUR INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 48 hrs 15 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 48 hrs 15 D

242512

5.0500

2.0

8.22

8.18

Sample pH 4 R2 48 hrs 15 D

240327

5.0500

2.0

8.14

Control pH 7 48 hrs 15 D

BLOQ

-

-

-

-

Sample pH 7 R1 48 hrs 15 D

235688

5.0500

2.0

7.98

7.94

Sample pH 7 R2 48 hrs 15 D

232824

5.0500

2.0

7.89

Control pH 9 48 hrs 15 D

BLOQ

-

-

-

-

Sample pH 9 R1 48 hrs 15 D

242963

5.0500

2.0

8.23

8.20

Sample pH 9 R2 48 hrs 15 D

240853

5.0500

2.0

8.16

TABLE 21. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 48thHOUR INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 48 hrs 25 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 48 hrs 25 D

177072

5.0500

2.0

6.00

5.97

Sample pH 4 R2 48 hrs 25 D

175195

5.0500

2.0

5.94

Control pH 7 48 hrs 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 48 hrs 25 D

168500

5.0500

2.0

5.71

5.73

Sample pH 7 R2 48 hrs 25 D

169504

5.0500

2.0

5.74

Control pH 9 48 hrs 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 48 hrs 25 D

182696

5.0500

2.0

6.19

6.13

Sample pH 9 R2 48 hrs 25 D

179009

5.0500

2.0

6.06

TABLE 22. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 48thHOUR INCUBATED AT 50°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 48 hrs 50 D

BLOQ

298122

-

-

-

-

Sample pH 4 R1 48 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

BLOQ

Sample pH 4 R2 48 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

Control pH 7 48 hrs 50 D

BLOQ

-

-

-

-

Sample pH 7 R1 48 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

BLOQ

Sample pH 7 R2 48 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

Control pH 9 48 hrs 50 D

BLOQ

-

-

-

-

Sample pH 9 R1 48 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

BLOQ

Sample pH 9 R2 48 hrs 50 D

BLOQ

5.0500

2.0

BLOQ

TABLE 23. SYSTEM SUITABILITY STANDARD (Date of Analysis: 11/12/2020)

Standard

 Peak Area (mAU)

System Suitability Standard-Rep1

286751

System Suitability Standard-Rep2

285765

System Suitability Standard-Rep3

283806

System Suitability Standard-Rep4

284622

System Suitability Standard-Rep5

284386

Average

285066

SD (±)

1181

%RSD

0.41

 

 

TABLE 24. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 72ndHOUR INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 72 hrs 15 D

BLOQ

285066

-

-

-

-

Sample pH 4 R1 72 hrs 15 D

220822

5.0450

2.0

7.82

7.76

Sample pH 4 R2 72 hrs 15 D

217508

5.0450

2.0

7.70

Control pH 7 72 hrs 15 D

BLOQ

-

-

-

-

Sample pH 7 R1 72 hrs 15 D

217869

5.0450

2.0

7.71

7.68

Sample pH 7 R2 72 hrs 15 D

215937

5.0450

2.0

7.64

Control pH 9 72 hrs 15 D

BLOQ

-

-

-

-

Sample pH 9 R1 72 hrs 15 D

208082

5.0450

2.0

7.37

7.29

Sample pH 9 R2 72 hrs 15 D

203783

5.0450

2.0

7.21

TABLE 25. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 72ndHOUR INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 72 hrs 25 D

BLOQ

285066

-

-

-

-

Sample pH 4 R1 72 hrs 25 D

166713

5.0450

2.0

5.90

5.89

Sample pH 4 R2 72 hrs 25 D

166175

5.0450

2.0

5.88

Control pH 7 72 hrs 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 72 hrs 25 D

159118

5.0450

2.0

5.63

5.63

Sample pH 7 R2 72 hrs 25 D

159196

5.0450

2.0

5.63

Control pH 9 72 hrs 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 72 hrs 25 D

171494

5.0450

2.0

6.07

6.07

Sample pH 9 R2 72 hrs 25 D

171370

5.0450

2.0

6.07

TABLE 26. SYSTEM SUITABILITY STANDARD (Date of Analysis: 14/12/2020)

Standard

 Peak Area (mAU)

System Suitability Standard-Rep1

285943

System Suitability Standard-Rep2

285902

System Suitability Standard-Rep3

283806

System Suitability Standard-Rep4

284386

System Suitability Standard-Rep5

285382

Average

285084

SD (±)

951

%RSD

0.33

 

TABLE 27. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 144thHOUR (DAY 6) INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 Day 6 15 D

BLOQ

285084

-

-

-

-

Sample pH 4 R1 Day 6 15 D

184446

5.0400

2.0

6.52

6.43

Sample pH 4 R2 Day 6 15 D

178900

5.0400

2.0

6.33

Control pH 7 Day 6 15 D

BLOQ

-

-

-

-

Sample pH 7 R1 Day 6 15 D

185136

5.0400

2.0

6.55

6.54

Sample pH 7 R2 Day 6 15 D

184656

5.0400

2.0

6.53

Control pH 9 Day 6 15 D

BLOQ

-

-

-

-

Sample pH 9 R1 Day 6 15 D

197761

5.0400

2.0

6.99

6.92

Sample pH 9 R2 Day 6 15 D

193463

5.0400

2.0

6.84

TABLE 28. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 144thHOUR (DAY 6) INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 Day 6 25 D

BLOQ

285084

-

-

-

-

Sample pH 4 R1 Day 6 25 D

110527

5.0400

2.0

3.91

3.90

Sample pH 4 R2 Day 6 25 D

109798

5.0400

2.0

3.88

Control pH 7 Day 6 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 Day 6 25 D

82028

5.0400

2.0

2.90

2.95

Sample pH 7 R2 Day 6 25 D

84670

5.0400

2.0

2.99

Control pH 9 Day 6 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 Day 6 25 D

103795

5.0400

2.0

3.67

3.69

Sample pH 9 R2 Day 6 25 D

105016

5.0400

2.0

3.71

TABLE 29. SYSTEM SUITABILITY STANDARD (Date of Analysis: 16/12/2020)

Standard

 Peak Area (mAU)

System Suitability Standard-Rep1

248744

System Suitability Standard-Rep2

246580

System Suitability Standard-Rep3

243967

System Suitability Standard-Rep4

237911

System Suitability Standard-Rep5

245357

Average

244512

SD (±)

4086

%RSD

1.67

 

TABLE 30. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 192ndHOUR (DAY 8) INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 Day 8 25 D

BLOQ

244512

-

-

-

-

Sample pH 4 R1 Day 8 25 D

64676

4.9100

2.0

2.60

2.57

Sample pH 4 R2 Day 8 25 D

62905

4.9100

2.0

2.53

Control pH 7 Day 8 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 Day 8 25 D

56917

4.9100

2.0

2.29

2.26

Sample pH 7 R2 Day 8 25 D

55529

4.9100

2.0

2.23

Control pH 9 Day 8 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 Day 8 25 D

65684

4.9100

2.0

2.64

2.68

Sample pH 9 R2 Day 8 25 D

67661

4.9100

2.0

2.72

TABLE 31. SYSTEM SUITABILITY STANDARD (Date of Analysis: 19/12/2020)

Standard

 Peak Area (mAU)

System Suitability Standard-Rep1

291402

System Suitability Standard-Rep2

294584

System Suitability Standard-Rep3

287031

System Suitability Standard-Rep4

293566

System Suitability Standard-Rep5

289161

Average

291149

SD (±)

3107

%RSD

1.07

TABLE 32. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 264thHOUR (DAY 11) INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 Day 11 25 D

BLOQ

291149

-

-

-

-

Sample pH 4 R1 Day 11 25 D

34260

5.0300

2.0

1.18

1.19

Sample pH 4 R2 Day 11 25 D

34796

5.0300

2.0

1.20

Control pH 7 Day 11 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 Day 11 25 D

33278

5.0300

2.0

1.15

1.16

Sample pH 7 R2 Day 11 25 D

33467

5.0300

2.0

1.16

Control pH 9 Day 11 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 Day 11 25 D

34785

5.0300

2.0

1.20

1.24

Sample pH 9 R2 Day 11 25 D

36906

5.0300

2.0

1.28

 

TABLE 33. SYSTEM SUITABILITY STANDARD (Date of Analysis: 23/12/2020)

Standard

 Peak Area (mAU)

System Suitability Standard-Rep1

264071

System Suitability Standard-Rep2

261685

System Suitability Standard-Rep3

261730

System Suitability Standard-Rep4

253785

System Suitability Standard-Rep5

255037

Average

259262

SD (±)

4553

%RSD

1.76

TABLE 34. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 360thHOUR (DAY 15) INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 Day 15 15 D

BLOQ

259262

-

-

-

-

Sample pH 4 R1 Day 15 15 D

107531

5.0500

2.0

4.19

4.17

Sample pH 4 R2 Day 15 15 D

106537

5.0500

2.0

4.15

Control pH 7 Day 15 15 D

BLOQ

-

-

-

-

Sample pH 7 R1 Day 15 15 D

105149

5.0500

2.0

4.10

4.10

Sample pH 7 R2 Day 15 15 D

105126

5.0500

2.0

4.10

Control pH 9 Day 15 15 D

BLOQ

-

-

-

-

Sample pH 9 R1 Day 15 15 D

122089

5.0500

2.0

4.76

4.75

Sample pH 9 R2 Day 15 15 D

121665

5.0500

2.0

4.74

 

TABLE 35. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 360thHOUR (DAY 15) INCUBATED AT 25°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 Day 15 25 D

BLOQ

259262

-

-

-

-

Sample pH 4 R1 Day 15 25 D

BLOQ

5.0500

2.0

BLOQ

BLOQ

Sample pH 4 R2 Day 15 25 D

BLOQ

5.0500

2.0

BLOQ

Control pH 7 Day 15 25 D

BLOQ

-

-

-

-

Sample pH 7 R1 Day 15 25 D

BLOQ

5.0500

2.0

BLOQ

BLOQ

Sample pH 7 R2 Day 15 25 D

BLOQ

5.0500

2.0

BLOQ

Control pH 9 Day 15 25 D

BLOQ

-

-

-

-

Sample pH 9 R1 Day 15 25 D

BLOQ

5.0500

2.0

BLOQ

BLOQ

Sample pH 9 R2 Day 15 25 D

BLOQ

5.0500

2.0

BLOQ

TABLE 36. SYSTEM SUITABILITY STANDARD (Date of Analysis: 30/12/2020)

Standard

 Peak Area (mAU)

System Suitability Standard-Rep1

281723

System Suitability Standard-Rep2

282081

System Suitability Standard-Rep3

285611

System Suitability Standard-Rep4

285876

System Suitability Standard-Rep5

284892

Average

284037

SD (±)

1986

%RSD

0.70

 

TABLE 37. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 528thHOUR (DAY 22) INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 Day 22 15 D

BLOQ

284037

-

-

-

-

Sample pH 4 R1 Day 22 15 D

77047

5.0550

2.0

2.74

2.72

Sample pH 4 R2 Day 22 15 D

75740

5.0550

2.0

2.70

Control pH 7 Day 22 15 D

BLOQ

-

-

-

-

Sample pH 7 R1 Day 22 15 D

73276

5.0550

2.0

2.61

2.58

Sample pH 7 R2 Day 22 15 D

71364

5.0550

2.0

2.54

Control pH 9 Day 22 15 D

BLOQ

-

-

-

-

Sample pH 9 R1 Day 22 15 D

75604

5.0550

2.0

2.69

2.71

Sample pH 9 R2 Day 22 15 D

76635

5.0550

2.0

2.73

TABLE 38. SYSTEM SUITABILITY STANDARD (Date of Analysis: 07/01/2021)

Standard

 Peak Area (mAU)

System Suitability Standard-Rep1

281272

System Suitability Standard-Rep2

280479

System Suitability Standard-Rep3

281673

System Suitability Standard-Rep4

277167

System Suitability Standard-Rep5

271710

Average

278460

SD (±)

4170

% RSD

1.50

 

TABLE 39. CONCENTRATION OF1, 3-PROPENE SULTONEIN THE pH 4, pH 7 AND pH 9 BUFFER SOLUTIONS AT 720thHOUR (DAY 30) INCUBATED AT 15°C

Sample Code

 Peak Area (mAU)

 Mean Standard Peak Area (mAU)

Standard Conc. (mg/L)

Dilution Factor

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Control pH 4 Day 30 15 D

BLOQ

278460

-

-

-

-

Sample pH 4 R1 Day 30 15 D

53354

5.0650

2.0

1.94

1.92

Sample pH 4 R2 Day 30 15 D

52279

5.0650

2.0

1.90

Control pH 7 Day 30 15 D

BLOQ

-

-

-

-

Sample pH 7 R1 Day 30 15 D

50461

5.0650

2.0

1.84

1.85

Sample pH 7 R2 Day 30 15 D

51078

5.0650

2.0

1.86

Control pH 9 Day 30 15 D

BLOQ

-

-

-

-

Sample pH 9 R1 Day 30 15 D

54636

5.0650

2.0

1.99

1.98

Sample pH 9 R2 Day 30 15 D

54280

5.0650

2.0

1.97

 

TABLE 40. TIER 2 - HYDROLYSIS RATE CONSTANT AND HALF-LIFE OF1, 3-PROPENE SULTONE INpH 4 BUFFER SAMPLES INCUBATED AT 15°C

Occasion (Hours)

Sample Code

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Log of Mean Concentration

Rate Constant (Kobs)hour-1

0

Sample pH 4 R1 0 hour

9.37

9.37

0.9717

-

Sample pH 4 R2 0 hour

9.37

4.0

Sample pH 4 R1 4 hours

9.31

9.33

0.9699

0.0011

Sample pH 4 R2 4 hours

9.34

8.0

Sample pH 4 R1 8 hours

9.17

9.19

0.9633

0.0024

Sample pH 4 R2 8 hours

9.20

12.0

Sample pH 4 R1 12 hours

9.07

9.09

0.9586

0.0025

Sample pH 4 R2 12 hours

9.10

20.0

Sample pH 4 R1 20 hours

8.99

9.02

0.9552

0.0019

Sample pH 4 R2 20 hours

9.04

24.0

Sample pH 4 R1 24 hours

8.89

8.97

0.9528

0.0018

Sample pH 4 R2 24 hours

9.04

30.0

Sample pH 4 R1 30 hours

8.41

8.33

0.9206

0.0039

Sample pH 4 R2 30 hours

8.25

48.0

Sample pH 4 R1 48 hours

8.22

8.18

0.9128

0.0028

Sample pH 4 R2 48 hours

8.14

72.0

Sample pH 4 R1 72 hours

7.82

7.76

0.8899

0.0026

Sample pH 4 R2 72 hours

7.70

144.0

Sample pH 4 R1 144 hours

6.52

6.43

0.8082

0.0026

Sample pH 4 R2 144 hours

6.33

360.0

Sample pH 4 R1 360 hours

4.19

4.17

0.6201

0.0022

Sample pH 4 R2 360 hours

4.15

528.0

Sample pH 4 R1 528 hours

2.74

2.72

0.4346

0.0023

Sample pH 4 R2 528 hours

2.70

720.0

Sample pH 4 R1 720 hours

1.94

1.92

0.2833

0.0022

Sample pH 4 R2 720 hours

1.90

Mean Rate Constant (Kobs)hour-1

0.0024

Half-life (t1/2) hour

288.75

TABLE 41. TIER 2 - HYDROLYSIS RATE CONSTANT AND HALF-LIFE OF1, 3-PROPENE SULTONE INpH 7 BUFFER SAMPLES INCUBATED AT 15°C

Occasion (Hours)

Sample Code

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Log of Mean Concentration

Rate Constant (Kobs)hour-1

0

Sample pH 7 R1 0 hour

9.33

9.30

0.9685

-

Sample pH 7 R2 0 hour

9.26

4.0

Sample pH 7 R1 4 hours

9.23

9.23

0.9652

0.0019

Sample pH 7 R2 4 hours

9.23

8.0

Sample pH 7 R1 8 hours

9.21

9.21

0.9643

0.0012

Sample pH 7 R2 8 hours

9.21

12.0

Sample pH 7 R1 12 hours

8.90

8.90

0.9494

0.0037

Sample pH 7 R2 12 hours

8.89

20.0

Sample pH 7 R1 20 hours

8.75

8.83

0.9460

0.0026

Sample pH 7 R2 20 hours

8.90

24.0

Sample pH 7 R1 24 hours

8.66

8.70

0.9395

0.0028

Sample pH 7 R2 24 hours

8.73

30.0

Sample pH 7 R1 30 hours

8.33

8.38

0.9232

0.0035

Sample pH 7 R2 30 hours

8.43

48.0

Sample pH 7 R1 48 hours

7.98

7.94

0.8998

0.0033

Sample pH 7 R2 48 hours

7.89

72.0

Sample pH 7 R1 72 hours

7.71

7.68

0.8854

0.0027

Sample pH 7 R2 72 hours

7.64

144.0

Sample pH 7 R1 144 hours

6.55

6.54

0.8156

0.0024

Sample pH 7 R2 144 hours

6.53

360.0

Sample pH 7 R1 360 hours

4.10

4.10

0.6128

0.0023

Sample pH 7 R2 360 hours

4.10

528.0

Sample pH 7 R1 528 hours

2.61

2.58

0.4116

0.0024

Sample pH 7 R2 528 hours

2.54

720.0

Sample pH 7 R1 720 hours

1.84

1.85

0.2672

0.0022

Sample pH 7 R2 720 hours

1.86

Mean Rate Constant (Kobs)hour-1

0.0026

Half-life (t1/2) hour

266.54

TABLE 42. TIER 2 - HYDROLYSIS RATE CONSTANT AND HALF-LIFE OF1, 3-PROPENE SULTONE INpH 9 BUFFER SAMPLES INCUBATED AT 15°C

Occasion (Hours)

Sample Code

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Log of Mean Concentration

Rate Constant (Kobs)hour-1

0

Sample pH 9 R1 0 hour

9.41

9.38

0.9722

-

Sample pH 9 R2 0 hour

9.35

4.0

Sample pH 9 R1 4 hours

9.37

9.33

0.9699

0.0013

Sample pH 9 R2 4 hours

9.29

8.0

Sample pH 9 R1 8 hours

9.25

9.25

0.9661

0.0017

Sample pH 9 R2 8 hours

9.25

12.0

Sample pH 9 R1 12 hours

9.12

9.13

0.9605

0.0023

Sample pH 9 R2 12 hours

9.14

20.0

Sample pH 9 R1 20 hours

9.00

8.97

0.9528

0.0022

Sample pH 9 R2 20 hours

8.93

24.0

Sample pH 9 R1 24 hours

8.85

8.88

0.9484

0.0023

Sample pH 9 R2 24 hours

8.91

30.0

Sample pH 9 R1 30 hours

8.57

8.58

0.9335

0.0030

Sample pH 9 R2 30 hours

8.59

48.0

Sample pH 9 R1 48 hours

8.23

8.20

0.9138

0.0028

Sample pH 9 R2 48 hours

8.16

72.0

Sample pH 9 R1 72 hours

7.37

7.29

0.8627

0.0035

Sample pH 9 R2 72 hours

7.21

144.0

Sample pH 9 R1 144 hours

6.99

6.92

0.8401

0.0021

Sample pH 9 R2 144 hours

6.84

360.0

Sample pH 9 R1 360 hours

4.76

4.75

0.6767

0.0019

Sample pH 9 R2 360 hours

4.74

528.0

Sample pH 9 R1 528 hours

2.69

2.71

0.4330

0.0024

Sample pH 9 R2 528 hours

2.73

720.0

Sample pH 9 R1 720 hours

1.99

1.98

0.2967

0.0022

Sample pH 9 R2 720 hours

1.97

Mean Rate Constant (Kobs)hour-1

0.0023

Half-life (t1/2) hour

301.30

TABLE 43. TIER 2 - HYDROLYSIS RATE CONSTANT AND HALF-LIFE OF1, 3-PROPENE SULTONE INpH 4 BUFFER SAMPLES INCUBATED AT 25°C

Occasion (Hours)

Sample Code

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Log of Mean Concentration

Rate Constant (Kobs)hour-1

0

Sample pH 4 R1 0 hour

9.37

9.37

0.9717

-

Sample pH 4 R2 0 hour

9.37

4.0

Sample pH 4 R1 4 hours

9.25

9.21

0.9643

0.0043

Sample pH 4 R2 4 hours

9.16

8.0

Sample pH 4 R1 8 hours

8.75

8.79

0.9440

0.0080

Sample pH 4 R2 8 hours

8.82

12.0

Sample pH 4 R1 12 hours

8.49

8.59

0.9340

0.0072

Sample pH 4 R2 12 hours

8.69

20.0

Sample pH 4 R1 20 hours

8.30

8.29

0.9186

0.0061

Sample pH 4 R2 20 hours

8.28

24.0

Sample pH 4 R1 24 hours

7.87

7.92

0.8987

0.0070

Sample pH 4 R2 24 hours

7.97

30.0

Sample pH 4 R1 30 hours

6.96

7.03

0.8470

0.0096

Sample pH 4 R2 30 hours

7.10

48.0

Sample pH 4 R1 48 hours

6.00

5.97

0.7760

0.0094

Sample pH 4 R2 48 hours

5.94

72.0

Sample pH 4 R1 72 hours

5.90

5.89

0.7701

0.0064

Sample pH 4 R2 72 hours

5.88

144.0

Sample pH 4 R1 144 hours

3.91

3.90

0.5911

0.0061

Sample pH 4 R2 144 hours

3.88

192.0

Sample pH 4 R1 192 hours

2.60

2.57

0.4099

0.0067

Sample pH 4 R2 192 hours

2.53

264.0

Sample pH 4 R1 264 hours

1.18

1.19

0.0755

0.0078

Sample pH 4 R2 264 hours

1.20

360.0

Sample pH 4 R1 360 hours

0.00

0.00

0.0000

0.0000

Sample pH 4 R2 360 hours

0.00

Mean Rate Constant (Kobs)hour-1

0.0071

Half-life (t1/2) hour

97.61

 

TABLE 44. TIER 2 - HYDROLYSIS RATE CONSTANT AND HALF-LIFE OF1, 3-PROPENE SULTONE INpH 7 BUFFER SAMPLES INCUBATED AT 25°C

Occasion (Hours)

Sample Code

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Log of Mean Concentration

Rate Constant (Kobs)hour-1

0

Sample pH 7 R1 0 hour

9.33

9.30

0.9685

-

Sample pH 7 R2 0 hour

9.26

4.0

Sample pH 7 R1 4 hours

9.12

9.13

0.9605

0.0046

Sample pH 7 R2 4 hours

9.14

8.0

Sample pH 7 R1 8 hours

8.89

8.88

0.9484

0.0058

Sample pH 7 R2 8 hours

8.86

12.0

Sample pH 7 R1 12 hours

8.41

8.36

0.9222

0.0089

Sample pH 7 R2 12 hours

8.30

20.0

Sample pH 7 R1 20 hours

8.54

8.55

0.9320

0.0042

Sample pH 7 R2 20 hours

8.56

24.0

Sample pH 7 R1 24 hours

7.35

7.47

0.8733

0.0091

Sample pH 7 R2 24 hours

7.59

30.0

Sample pH 7 R1 30 hours

6.92

6.91

0.8395

0.0099

Sample pH 7 R2 30 hours

6.89

48.0

Sample pH 7 R1 48 hours

5.71

5.73

0.7582

0.0101

Sample pH 7 R2 48 hours

5.74

72.0

Sample pH 7 R1 72 hours

5.63

5.63

0.7505

0.0070

Sample pH 7 R2 72 hours

5.63

144.0

Sample pH 7 R1 144 hours

2.90

2.95

0.4698

0.0080

Sample pH 7 R2 144 hours

2.99

192.0

Sample pH 7 R1 192 hours

2.29

2.26

0.3541

0.0074

Sample pH 7 R2 192 hours

2.23

264.0

Sample pH 7 R1 264 hours

1.15

1.16

0.0645

0.0079

Sample pH 7 R2 264 hours

1.16

360.0

Sample pH 7 R1 360 hours

0.00

0.00

0.0000

0.0000

Sample pH 7 R2 360 hours

0.00

Mean Rate Constant (Kobs)hour-1

0.0075

Half-life (t1/2) hour

92.40

 

TABLE 45. TIER-2 - HYDROLYSIS RATE CONSTANT AND HALF-LIFE OF1, 3-PROPENE SULTONE INpH 9 BUFFER SAMPLES INCUBATED AT 25°C

Occasion (Hours)

Sample Code

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Log of Mean Concentration

Rate Constant (Kobs)hour-1

0

Sample pH 9 R1 0 hour

9.41

9.38

0.9722

-

Sample pH 9 R2 0 hour

9.35

4.0

Sample pH 9 R1 4 hours

9.23

9.26

0.9666

0.0032

Sample pH 9 R2 4 hours

9.28

8.0

Sample pH 9 R1 8 hours

9.00

9.06

0.9571

0.0043

Sample pH 9 R2 8 hours

9.11

12.0

Sample pH 9 R1 12 hours

8.58

8.62

0.9355

0.0070

Sample pH 9 R2 12 hours

8.65

20.0

Sample pH 9 R1 20 hours

8.43

8.45

0.9269

0.0052

Sample pH 9 R2 20 hours

8.46

24.0

Sample pH 9 R1 24 hours

7.97

7.90

0.8976

0.0072

Sample pH 9 R2 24 hours

7.83

30.0

Sample pH 9 R1 30 hours

6.71

6.67

0.8241

0.0114

Sample pH 9 R2 30 hours

6.62

48.0

Sample pH 9 R1 48 hours

6.19

6.13

0.7875

0.0089

Sample pH 9 R2 48 hours

6.06

72.0

Sample pH 9 R1 72 hours

6.07

6.07

0.7832

0.0060

Sample pH 9 R2 72 hours

6.07

144.0

Sample pH 9 R1 144 hours

3.67

3.69

0.5670

0.0065

Sample pH 9 R2 144 hours

3.71

192.0

Sample pH 9 R1 192 hours

2.64

2.68

0.4281

0.0065

Sample pH 9 R2 192 hours

2.72

264.0

Sample pH 9 R1 264 hours

1.20

1.24

0.0934

0.0077

Sample pH 9 R2 264 hours

1.28

360.0

Sample pH 9 R1 360 hours

0.00

0.00

0.0000

0.0000

Sample pH 9 R2 360 hours

0.00

Mean Rate Constant (Kobs)hour-1

0.0067

Half-life (t1/2) hour

103.43

TABLE 46. TIER 2 - HYDROLYSIS RATE CONSTANT AND HALF-LIFE OF1, 3-PROPENE SULTONE INpH 4 BUFFER SAMPLES INCUBATED AT 50°C

Occasion (Hours)

Sample Code

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Log of Mean Concentration

Rate Constant (Kobs)hour-1

0

Sample pH 4 R1 0 hour

9.37

9.37

0.9717

-

Sample pH 4 R2 0 hour

9.37

4.0

Sample pH 4 R1 4 hours

7.98

7.95

0.9004

0.0411

Sample pH 4 R2 4 hours

7.92

8.0

Sample pH 4 R1 8 hours

7.22

7.27

0.8615

0.0317

Sample pH 4 R2 8 hours

7.31

12.0

Sample pH 4 R1 12 hours

4.70

4.71

0.6730

0.0573

Sample pH 4 R2 12 hours

4.72

20.0

Sample pH 4 R1 20 hours

1.29

1.28

0.1072

0.0996

Sample pH 4 R2 20 hours

1.27

24.0

Sample pH 4 R1 24 hours

0.55

0.55

-0.2596

0.1182

Sample pH 4 R2 24 hours

0.54

30.0

Sample pH 4 R1 30 hours

0.00

0.00

0.0000

0.0000

Sample pH 4 R2 30 hours

0.00

48.0

Sample pH 4 R1 48 hours

0.00

0.00

0.0000

0.0000

Sample pH 4 R2 48 hours

0.00

Mean Rate Constant (Kobs)hour-1

0.0696

Half-life (t1/2) hour

9.96

 

 

TABLE 47. TIER-2 - HYDROLYSIS RATE CONSTANT AND HALF-LIFE OF1, 3-PROPENE SULTONE INpH 7 BUFFER SAMPLES INCUBATED AT 50°C

Occasion (Hours)

Sample Code

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Log of Mean Concentration

Rate Constant (Kobs)hour-1

0

Sample pH 7 R1 0 hour

9.33

9.30

0.9685

-

Sample pH 7 R2 0 hour

9.26

4.0

Sample pH 7 R1 4 hours

8.16

8.13

0.9101

0.0336

Sample pH 7 R2 4 hours

8.09

8.0

Sample pH 7 R1 8 hours

7.74

7.76

0.8899

0.0226

Sample pH 7 R2 8 hours

7.77

12.0

Sample pH 7 R1 12 hours

3.71

3.70

0.5682

0.0768

Sample pH 7 R2 12 hours

3.68

20.0

Sample pH 7 R1 20 hours

1.22

1.22

0.0864

0.1016

Sample pH 7 R2 20 hours

1.22

24.0

Sample pH 7 R1 24 hours

0.58

0.58

-0.2366

0.1156

Sample pH 7 R2 24 hours

0.57

30.0

Sample pH 7 R1 30 hours

0.00

0.00

0.0000

0.0000

Sample pH 7 R2 30 hours

0.00

48.0

Sample pH 7 R1 48 hours

0.00

0.00

0.0000

0.0000

Sample pH 7 R2 48 hours

0.00

Mean Rate Constant (Kobs)hour-1

0.0700

Half-life (t1/2) hour

9.90

 

 

TABLE 48. TIER-2 - HYDROLYSIS RATE CONSTANT AND HALF-LIFE OF1, 3-PROPENE SULTONE INpH 9 BUFFER SAMPLES INCUBATED AT 50°C

Occasion (Hours)

Sample Code

Obtained Concentration (mg/L)

Mean Obtained Concentration (mg/L)

Log of Mean Concentration

Mean Rate Constant (Kobs)hour-1

0

Sample pH 9 R1 0 hour

9.41

9.38

0.9722

-

Sample pH 9 R2 0 hour

9.35

4.0

Sample pH 9 R1 4 hours

8.15

8.15

0.9112

0.0351

Sample pH 9 R2 4 hours

8.14

8.0

Sample pH 9 R1 8 hours

7.62

7.61

0.8814

0.0261

Sample pH 9 R2 8 hours

7.60

12.0

Sample pH 9 R1 12 hours

3.86

3.87

0.5877

0.0738

Sample pH 9 R2 12 hours

3.88

20.0

Sample pH 9 R1 20 hours

1.14

1.14

0.0569

0.1054

Sample pH 9 R2 20 hours

1.13

24.0

Sample pH 9 R1 24 hours

0.56

0.57

-0.2441

0.1167

Sample pH 9 R2 24 hours

0.57

30.0

Sample pH 9 R1 30 hours

0.00

0.00

0.0000

0.0000

Sample pH 9 R2 30 hours

0.00

48.0

Sample pH 9 R1 48 hours

0.00

0.00

0.0000

0.0000

Sample pH 9 R2 48 hours

0.00

Mean Rate Constant (Kobs)hour-1

0.0714

Half-life (t1/2) hour

9.71

Validity criteria fulfilled:
yes
Conclusions:
PST is hydrolysed, but no hydrolysis products are observed using HPLC method.
The preliminary test at 50± 0.5°C after 5 days, the test item 1,3-Propene Sultone was found to be hydrolytically unstable due to 100% hydrolyzed in pH 4.0, pH 7.0 and pH 9.0 buffer test solutions.
In further tests tier 2, the hydrolysis of the test item was investigated as a function of pH (4, 7 and 9) at 15± 0.5°C, 25± 0.5°C and 50± 0.5°C respectively.
At pH 4, the rate constant and half-life of the reactions at 25± 0.5°C was determined to be 0.0071 h-1 and 97.61 h, respectively.
At pH 7, the rate constant and half-life of the reactions at 25± 0.5°C was determined to be 0.0075 h-1 and 92.40 h, respectively.
At pH 9, the rate constant and half-life of the reactions at 25± 0.5°C was determined to be 0.0067 h-1 and 103.43 h, respectively.
Executive summary:

The hydrolysis of the test item as a function of pH in aqueous solution was determined according to OECD guideline 111.

A preliminary test (Tier 1) was performed. The rate of hydrolysis at 50 ± 0.5°C was assessed for pH 4, 7 and 9.The percent degradation of the test item were 100% at each pH 4, pH 7 and pH 9 buffers over a period of 5 days of incubation. Hence the test item was hydrolytically unstable in pH 4, pH 7 and pH 9 at 50± 0.5°Cafter 5 days.

Based on the results from the Preliminary test / Tier 1, further testing Tier 2 was conducted at pH 4, pH 7 and pH 9with solutions being maintained at 15.0 ± 0.5°C, 25.0 ± 0.5°C and 50.0 ± 0.5°C for various time periods.

Based on tier 2 results, the determined degradation rate constant and half-life values were provided below.

Sterile Buffer

Temperature (°C)

Rate constant kobs(hour-1)

Half Life t1/2(hours)

pH 4

15.0

0.0024

288.75

25.0

0.0071

97.61

50.0

0.0696

9.96

pH 7

15.0

0.0026

266.54

25.0

0.0075

92.40

50.0

0.0700

9.90

pH 9

15.0

0.0023

301.30

25.0

0.0067

103.43

50.0

0.0714

9.71

Based on Tier 2 results, no other breakdown products are detected, hence tier 3 test for the identification of other products was not performed.

The mean logarithms of the relative concentrations were plotted against time using linear regression analysis. At all temperatures of15± 0.5°C, 25± 0.5°C and 50± 0.5°C, linear relationships were obtained and the correlation coefficient (r2) were ranged between 0.9244 to 0.9974.

Conclusion:

The preliminarytest at 50± 0.5°Cafter 5 days, the test item 1,3-Propene Sultone was found to be hydrolytically unstable due to 100% hydrolyzed in pH 4.0, pH 7.0 and pH 9.0 buffer test solutions.

In further tests tier 2, the hydrolysis of the test item was investigated as a function of pH (4, 7 and 9) at 15± 0.5°C, 25± 0.5°C and 50± 0.5°C respectively.

AtpH 4, the rate constant and half-life of the reactions at 25± 0.5°Cwas determined to be 0.0071 h-1and 97.61 h, respectively.

At pH 7, the rate constant and half-life of the reactions at 25± 0.5°Cwas determined to be 0.0075 h-1and 92.40 h, respectively.

At pH 9, the rate constant and half-life of the reactions at 25± 0.5°Cwas determined to be 0.0067 h-1and 103.43 h, respectively.

Description of key information

The hydrolysis of the test item as a function of pH in aqueous solution was determined according to OECD guideline 111.

A preliminary test (Tier 1) was performed. The rate of hydrolysis at 50 ± 0.5°C was assessed for pH 4, 7 and 9.

Based on the results from the Preliminary test / Tier 1, further testing Tier 2 was conducted at pH 4, pH 7 and pH 9 with solutions being maintained at 15.0 ± 0.5°C, 25.0 ± 0.5°C and 50.0 ± 0.5°C for various time periods.

The half-life for hydrolysis of PST is described as below:

pH=4.0: Half-life are 288.75, 97.61, 9.96 h at temperature of 15, 25, 50 ℃, respectively.

pH=7.0: Half-life are 266.54, 92.40, 9.90 h at temperature of 15, 25, 50 ℃, respectively.

pH=9.0: Half-life are 301.30, 103.43, 9.71 h at temperature of 15, 25, 50 ℃, respectively.

Based on Tier 2 results, no other breakdown products are detected, hence tier 3 test for the identification of other products was not performed.

Key value for chemical safety assessment

Half-life for hydrolysis:
92.4 h
at the temperature of:
25 °C

Additional information