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Physical & Chemical properties

Water solubility

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Reference
Endpoint:
water solubility
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Justification for type of information:
data is from modelling database
Qualifier:
according to guideline
Guideline:
other: estimated data
Principles of method if other than guideline:
WSKOW v1.42 was used to estimate the water solubility of Ethylbenzenesulphonic acid
GLP compliance:
not specified
Type of method:
other: estimated data
Specific details on test material used for the study:
- Name of test material : Ethylbenzenesulphonic acid
- Molecular formula : C8H10O3S
- Molecular weight : 186.23 g/mol
- Smiles notation : c1(ccc(CC)cc1)S(O)(=O)=O
- InChl : 1S/C8H10O3S/c1-2-7-3-5-8(6-4-7)12(9,10)11/h3-6H,2H2,1H3,(H,9,10,11)
- Substance type: Organic
- Physical state: Solid
Key result
Water solubility:
65 830 mg/L
Conc. based on:
test mat.
Temp.:
25 °C
Remarks on result:
other: Estimated data
Conclusions:
The estimated water solubility of Ethylbenzenesulphonic acid at 25 deg C was 65830 mg/l.
Executive summary:

WSKOW v1.42 was used to estimate the water solubility of Ethylbenzenesulphonic acid.

The estimated water solubility of Ethylbenzenesulphonic acid at 25 deg C was 65830 mg/l.

Based on the estimated value, Ethylbenzenesulphonic acid was very soluble in water.

Description of key information

The estimated water solubility of Ethylbenzenesulphonic acid at 25 deg C was 65830 mg/l.

Key value for chemical safety assessment

Water solubility:
65 830 mg/L
at the temperature of:
25 °C

Additional information

WSKOW v1.42 was used to estimate the water solubility of Ethylbenzenesulphonic acid.

The estimated water solubility of Ethylbenzenesulphonic acid at 25 deg C was 65830 mg/l.

Based on the estimated value, Ethylbenzenesulphonic acid was very soluble in water.