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EC number: 300-947-2 | CAS number: 93964-99-9
Vapour pressure
Administrative data
- Endpoint:
- vapour pressure
- Type of information:
- experimental study
- Adequacy of study:
- key study
- Study period:
- Experimental starting date: 24 June 2016 Experimental completion date: 28 June 2016
- Reliability:
- 1 (reliable without restriction)
Data source
Reference
- Reference Type:
- study report
- Title:
- Unnamed
- Year:
- 2 016
- Report date:
- 2016
Materials and methods
Test guidelineopen allclose all
- Qualifier:
- according to guideline
- Guideline:
- EU Method A.4 (Vapour Pressure)
- Qualifier:
- according to guideline
- Guideline:
- OECD Guideline 104 (Vapour Pressure Curve)
- GLP compliance:
- yes
- Type of method:
- effusion method: vapour pressure balance
Test material
- Reference substance name:
- O,O-dibutyl hydrogen thiophosphate, compound with 1-octylamine (1:1)
- EC Number:
- 300-947-2
- EC Name:
- O,O-dibutyl hydrogen thiophosphate, compound with 1-octylamine (1:1)
- Cas Number:
- 93964-99-9
- Molecular formula:
- C8H19N.C8H19O3PS
- IUPAC Name:
- octan-1-amine dibutyl sulfanylphosphonate
- Reference substance name:
- Octylamine
- EC Number:
- 203-916-0
- EC Name:
- Octylamine
- Cas Number:
- 111-86-4
- Molecular formula:
- C8H19N
- IUPAC Name:
- octan-1-amine
- Test material form:
- liquid
Constituent 1
impurity 1
- Specific details on test material used for the study:
- Information as provided by the Sponsor. The Certificate of Analysis provided by the Sponsor is presented as Annex 3 (Please see Attachment Section of this Summary).
Identification: X-19575 Phosphorothioic acid, O,O-dibutyl ester, compd. with 1-octanamine, CASRN 93964-99-9
Appearance/Physical state: Amber colored viscous liquid
Batch: X-019575-00-00
Purity: UVCB (treat as 100%)
Expiry: 01 June 2017
Storage conditions: Room temperature in the dark
Results and discussion
Vapour pressure
- Temp.:
- 25 °C
- Vapour pressure:
- 1.8 Pa
Any other information on results incl. tables
Results
Runs 2 to 6 Graphs of Log10Vapor Pressure vs Reciprocal Temperature are shown in the Attachment Section of this Summary.
Recorded temperatures, mass differences and the resulting calculated values of vapor pressure are shown in the following tables:
Run 2
Table 1 – Vapor Pressure Data
Temperature (ºC) |
Temperature (K) |
Reciprocal Temperature (K-1) |
Mass Difference (µg) |
Mass Difference (kg) |
Vapor Pressure (Pa) |
Log10Vp |
-10 |
263.15 |
0.003800114 |
136.45 |
1.365E-07 |
0.189427558 |
-0.722556839 |
-9 |
264.15 |
0.003785728 |
154.26 |
1.543E-07 |
0.214152401 |
-0.669277052 |
-8 |
265.15 |
0.003771450 |
174.86 |
1.749E-07 |
0.242750479 |
-0.614839905 |
-7 |
266.15 |
0.003757280 |
172.73 |
1.727E-07 |
0.239793493 |
-0.620162606 |
-6 |
267.15 |
0.003743215 |
189.37 |
1.894E-07 |
0.262894076 |
-0.580219200 |
-5 |
268.15 |
0.003729256 |
209.82 |
2.098E-07 |
0.291283916 |
-0.535683496 |
-4 |
269.15 |
0.003715400 |
221.85 |
2.219E-07 |
0.307984638 |
-0.511470946 |
-3 |
270.15 |
0.003701647 |
226.71 |
2.267E-07 |
0.314731563 |
-0.502059702 |
-2 |
271.15 |
0.003687996 |
255.90 |
2.559E-07 |
0.355254761 |
-0.449460093 |
-1 |
272.15 |
0.003674444 |
279.82 |
2.798E-07 |
0.388461849 |
-0.410651626 |
0 |
273.15 |
0.003660992 |
291.56 |
2.916E-07 |
0.404759977 |
-0.392802437 |
A plot of Log10(vapor pressure (Pa)) versus reciprocal temperature (1/T(K)) for Run 2 gives the following statistical data using an unweighted least squares treatment.
Slope: |
-2.28 x 103 |
Standard error in slope: |
94.3
|
Intercept: |
7.95 |
Standard error in intercept: |
0.352 |
The results obtained indicate the following vapor pressure relationship:
Log10(Vp (Pa)) = -2.28 x 103/temp(K) + 7.95
The above yields a vapor pressure (Pa) at 298.15 K with a common logarithm of 0.309.
Run 3
Table 2 – Vapor Pressure Data
Temperature (ºC) |
Temperature (K) |
Reciprocal Temperature (K-1) |
Mass Difference (µg) |
Mass Difference (kg) |
Vapor Pressure (Pa) |
Log10Vp |
-10 |
263.15 |
0.003800114 |
142.47 |
1.425E-07 |
0.197784861 |
-0.703806954 |
-9 |
264.15 |
0.003785728 |
153.34 |
1.533E-07 |
0.212875205 |
-0.671874920 |
-8 |
265.15 |
0.003771450 |
177.19 |
1.772E-07 |
0.245985116 |
-0.609091171 |
-7 |
266.15 |
0.003757280 |
178.09 |
1.781E-07 |
0.247234546 |
-0.606890845 |
-6 |
267.15 |
0.003743215 |
188.19 |
1.882E-07 |
0.261255934 |
-0.582933836 |
-5 |
268.15 |
0.003729256 |
199.06 |
1.991E-07 |
0.276346279 |
-0.558546379 |
-4 |
269.15 |
0.003715400 |
205.81 |
2.058E-07 |
0.285717008 |
-0.544063906 |
-3 |
270.15 |
0.003701647 |
237.79 |
2.378E-07 |
0.330113441 |
-0.481336792 |
-2 |
271.15 |
0.003687996 |
239.67 |
2.397E-07 |
0.332723363 |
-0.477916703 |
-1 |
272.15 |
0.003674444 |
265.33 |
2.653E-07 |
0.368346017 |
-0.433744022 |
0 |
273.15 |
0.003660992 |
279.35 |
2.794E-07 |
0.387809369 |
-0.411381703 |
A plot of Log10(vapor pressure (Pa)) versus reciprocal temperature (1/T(K)) for Run 3 gives the following statistical data using an unweighted least squares treatment.
Slope: |
-2.02 x 103 |
Standard error in slope: |
94.9
|
Intercept: |
7.00 |
Standard error in intercept: |
0.354 |
The results obtained indicate the following vapor pressure relationship:
Log10(Vp (Pa)) = -2.02 x 103/temp(K) + 7.00
The above yields a vapor pressure (Pa) at 298.15 K with a common logarithm of 0.208.
Run 4
Table 3 – Vapor Pressure Data
Temperature (ºC) |
Temperature (K) |
Reciprocal Temperature (K-1) |
Mass Difference (µg) |
Mass Difference (kg) |
Vapor Pressure (Pa) |
Log10Vp |
-10 |
263.15 |
0.003800114 |
143.05 |
1.431E-07 |
0.198590049 |
-0.702042517 |
-9 |
264.15 |
0.003785728 |
151.99 |
1.520E-07 |
0.211001060 |
-0.675715364 |
-8 |
265.15 |
0.003771450 |
167.06 |
1.671E-07 |
0.231922081 |
-0.634657902 |
-7 |
266.15 |
0.003757280 |
176.33 |
1.763E-07 |
0.244791215 |
-0.611204171 |
-6 |
267.15 |
0.003743215 |
182.03 |
1.820E-07 |
0.252704276 |
-0.597387410 |
-5 |
268.15 |
0.003729256 |
204.15 |
2.042E-07 |
0.283412503 |
-0.547580994 |
-4 |
269.15 |
0.003715400 |
220.05 |
2.201E-07 |
0.305485776 |
-0.515009006 |
-3 |
270.15 |
0.003701647 |
227.95 |
2.280E-07 |
0.316453000 |
-0.499690782 |
-2 |
271.15 |
0.003687996 |
244.41 |
2.444E-07 |
0.339303697 |
-0.469411408 |
-1 |
272.15 |
0.003674444 |
253.95 |
2.540E-07 |
0.352547662 |
-0.452782162 |
0 |
273.15 |
0.003660992 |
286.99 |
2.870E-07 |
0.398415646 |
-0.399663614 |
A plot of Log10(vapor pressure (Pa)) versus reciprocal temperature (1/T(K)) for Run 4 gives the following statistical data using an unweighted least squares treatment.
Slope: |
-2.09 x 103 |
Standard error in slope: |
62.3
|
Intercept: |
7.26 |
Standard error in intercept: |
0.232 |
The results obtained indicate the following vapor pressure relationship:
Log10(Vp (Pa)) = -2.09 x 103/temp(K) + 7.26
The above yields a vapor pressure (Pa) at 298.15 K with a common logarithm of 0.232.
Run 5
Table 4 – Vapor Pressure Data
Temperature (ºC) |
Temperature (K) |
Reciprocal Temperature (K-1) |
Mass Difference (µg) |
Mass Difference (kg) |
Vapor Pressure (Pa) |
Log10Vp |
-10 |
263.15 |
0.003800114 |
138.74 |
1.387E-07 |
0.192606665 |
-0.715328689 |
-9 |
264.15 |
0.003785728 |
144.47 |
1.445E-07 |
0.200561373 |
-0.697752706 |
-8 |
265.15 |
0.003771450 |
153.62 |
1.536E-07 |
0.213263917 |
-0.671082618 |
-7 |
266.15 |
0.003757280 |
167.83 |
1.678E-07 |
0.232991038 |
-0.632660784 |
-6 |
267.15 |
0.003743215 |
180.20 |
1.802E-07 |
0.250163767 |
-0.601775592 |
-5 |
268.15 |
0.003729256 |
196.52 |
1.965E-07 |
0.272820108 |
-0.564123623 |
-4 |
269.15 |
0.003715400 |
215.27 |
2.153E-07 |
0.298849912 |
-0.524546868 |
-3 |
270.15 |
0.003701647 |
221.22 |
2.212E-07 |
0.307110036 |
-0.512705991 |
-2 |
271.15 |
0.003687996 |
230.90 |
2.309E-07 |
0.320548356 |
-0.494106446 |
-1 |
272.15 |
0.003674444 |
265.90 |
2.659E-07 |
0.369137323 |
-0.432812041 |
0 |
273.15 |
0.003660992 |
285.27 |
2.853E-07 |
0.396027846 |
-0.402274277 |
A plot of Log10(vapor pressure (Pa)) versus reciprocal temperature (1/T(K)) for Run 5 gives the following statistical data using an unweighted least squares treatment.
Slope: |
-2.27 x 103 |
Standard error in slope: |
74.6
|
Intercept: |
7.89 |
Standard error in intercept: |
0.278 |
The results obtained indicate the following vapor pressure relationship:
Log10(Vp (Pa)) = -2.27 x 103/temp(K) + 7.89
The above yields a vapor pressure (Pa) at 298.15 K with a common logarithm of 0.284.
Run 6
Table 5 – Vapor Pressure Data
Temperature (ºC) |
Temperature (K) |
Reciprocal Temperature (K-1) |
Mass Difference (µg) |
Mass Difference (kg) |
Vapor Pressure (Pa) |
Log10Vp |
-10 |
263.15 |
0.003800114 |
135.90 |
1.359E-07 |
0.188664017 |
-0.724310922 |
-9 |
264.15 |
0.003785728 |
140.36 |
1.404E-07 |
0.194855640 |
-0.710287019 |
-8 |
265.15 |
0.003771450 |
156.36 |
1.564E-07 |
0.217067739 |
-0.663404717 |
-7 |
266.15 |
0.003757280 |
162.34 |
1.623E-07 |
0.225369511 |
-0.647104837 |
-6 |
267.15 |
0.003743215 |
173.73 |
1.737E-07 |
0.241181749 |
-0.617655559 |
-5 |
268.15 |
0.003729256 |
193.34 |
1.933E-07 |
0.268405453 |
-0.571208664 |
-4 |
269.15 |
0.003715400 |
196.05 |
1.961E-07 |
0.272167628 |
-0.565163532 |
-3 |
270.15 |
0.003701647 |
222.52 |
2.225E-07 |
0.308914769 |
-0.510161327 |
-2 |
271.15 |
0.003687996 |
232.27 |
2.323E-07 |
0.322450267 |
-0.491537259 |
-1 |
272.15 |
0.003674444 |
245.82 |
2.458E-07 |
0.341261139 |
-0.466913164 |
0 |
273.15 |
0.003660992 |
260.29 |
2.603E-07 |
0.361349206 |
-0.442072895 |
A plot of Log10(vapor pressure (Pa)) versus reciprocal temperature (1/T(K)) for Run 6 gives the following statistical data using an unweighted least squares treatment.
Slope: |
-2.11 x 103 |
Standard error in slope: |
62.5
|
Intercept: |
7.28 |
Standard error in intercept: |
0.233 |
The results obtained indicate the following vapor pressure relationship:
Log10(Vp (Pa)) = -2.11 x 103/temp(K) + 7.28
The above yields a vapor pressure (Pa) at 298.15 K with a common logarithm of 0.210.
Summary of Results
The values of vapor pressure at 25 °C extrapolated from each graph are summarized in the following table:
Table 6 Summary of Vapor Pressure Data
Run |
Log10[Vp(25ºC)] |
2 |
0.309 |
3 |
0.208 |
4 |
0.232 |
5 |
0.284 |
6 |
0.210 |
Mean |
0.249 |
Vapor Pressure |
1.77 Pa |
The test item did not change in appearance under the conditions used in the determination.
Applicant's summary and conclusion
- Conclusions:
- The vapor pressure of the test item has been determined to be 1.8 Pa at 25 ºC.
- Executive summary:
The determination was carried out using a procedure designed to be compatible with Method A.4 Vapour Pressure of Commission Regulation (EC) No 440/2008 of 30 May 2008 and Method 104 of the OECD Guidelines for Testing of Chemicals, 23 March 2006.
Conclusion
The vapor pressure of the test item has been determined to be 1.8 Pa at 25 ºC.
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