2-[(Trifluoromethyl)sulfanyl]benzoic acid structure

2-[(Trifluoromethyl)sulfanyl]benzoic acid

2-(trifluoromethylsulfanyl)benzoic acid

Also Known As: 2-((Trifluoromethyl)thio)benzoic acid|2-(trifluoromethylthio)benzoic acid|2-[(trifluoromethyl)thio]benzoic acid|2-(trifluoromethylsulfanyl)benzoic Acid|2-[(trifluoromethyl)sulfanyl]benzoic acid|o-(trifluoromethylthio)benzoic acid|2-(TRIFLUOROMETHYLTHIO)BENZOIC ACI|KS-00003R5B|2-((Trifluoromethyl)thio)benzoicacid|PS-7825|2-Carboxyphenyl trifluoromethyl sulphide|2-((trifluoromethyl)sulfanyl)benzoic acid|2-[(Trifluoromethyl)sulphanyl]benzoic acid|K-8271|2-[(Trifluoromethyl)sulphanyl]benzoic acid, 2-Carboxyphenyl trifluoromethyl sulphide|825-454-4

CAS: 37526-67-3
Molecular Formula C8H5F3O2S
Molecular Weight 221.99623 g/mol
LogP 2.9967
Topological Polar Surface Area 37.3 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
Rotatable Bonds 2
Exact Mass 221.99623
Monoisotopic Mass 221.99623
Heavy Atoms 14
Complexity 348.68478

Chemical Identifiers

CAS Number 37526-67-3
SMILES C1=CC=C(C(=C1)C(=O)O)SC(F)(F)F

Product Overview

2-[(Trifluoromethyl)sulfanyl]benzoic acid (CAS 37526-67-3), with molecular formula C8H5F3O2S and molecular weight 221.99623 g/mol. IUPAC: 2-(trifluoromethylsulfanyl)benzoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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