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Physical & Chemical properties

Surface tension

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Link to relevant study record(s)

Reference
Endpoint:
surface tension
Type of information:
other: Predicted data
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Predicted data
Reference:
Composition 0
Qualifier:
according to
Guideline:
other: as mentioned below
Principles of method if other than guideline:
ACD/I-Lab accepts smiles of test item and predicted data for surface tension using v12.1.0.50375.
GLP compliance:
not specified
Test material information:
Composition 1
Specific details on test material used for the study:
- Name of test material (as cited in study report): 3-methylsulphanilic acid
- Molecular formula: C7 H9 N O3 S
- Molecular weight: 187.218 g/mol
-Smiles: S(c1cc(c(N)cc1)C)(O)(=O)=O
- InChI: 1S/C7H9NO3S/c1-5-4-6(12(9,10)11)2-3-7(5)8/h2-4H,8H2,1H3,(H,9,10,11)
- Substance type: Organic
- Physical state: Solid
Key result
Surface tension:
61.7 other: dyne/cm
Remarks on result:
other: no other details available
Conclusions:
Based on the data from ACD labs, surface tension for 3-methylsulphanilic acid was predicted to be 61.7±3.0 dyne/cm.
Executive summary:

Based on the data from ACD labs, surface tension for 3-methylsulphanilic acid was predicted to be 61.7±3.0 dyne/cm.

Description of key information

Based on the data from ACD labs, surface tension for3-methylsulphanilic acidwas predicted to be61.7±3.0 dyne/cm.

Key value for chemical safety assessment

Surface tension:
61.7

Additional information

Based on the data from ACD labs, surface tension for3-methylsulphanilic acidwas predicted to be61.7±3.0 dyne/cm.