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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Administrative data

Endpoint:
water solubility
Type of information:
experimental study
Adequacy of study:
key study
Study period:
2010
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
other: Guideline study

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2010
Report date:
2010

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
EU Method A.6 (Water Solubility)
Deviations:
no
GLP compliance:
no
Type of method:
flask method

Test material

Constituent 1
Chemical structure
Reference substance name:
4-methanesulfonyl-2-nitrobenzoic acid
EC Number:
601-017-1
Cas Number:
110964-79-9
Molecular formula:
C8 H7 N1 O6 S1
IUPAC Name:
4-methanesulfonyl-2-nitrobenzoic acid
Details on test material:
Study performed on Commercial Batch n°30014009 which relates to NMSBA crude containing 15% water but in line with substance identity as described in Section 1.2

Results and discussion

Water solubility
Water solubility:
4.33 g/L
Temp.:
30 °C
pH:
ca. 1.9

Any other information on results incl. tables

3 trials have been prepared and analyzed:

Trial

g of Test Material

g of water

pH

Concentration
in the flash
g/L

HPLC
Titration
g/L

1

1.1690

49.1627

1.86

23.78

4.34

2

1.1636

49.4221

1.81

23.54

4.31

3

1.1666

49.4464

1.87

23.59

4.34

Average

 

 

 

 

4.33

The result from HPLC is based on pure substance NMSBA and thus reflects the real solubility of the substance even if test material was raw substance containing water.

Applicant's summary and conclusion

Conclusions:
Interpretation of results (migrated information): soluble (1000-10000 mg/L)
The solubility of the substance 2-Nitro-4-(methylsulfonyl)benzoic acid has been evaluated 4.33 g/l according to test method A.6. (Regulation n°440/2008)