2-[(2,2,2-Trifluoroethyl)thio]benzoic acid

CAS Registry Number®

162965-55-1
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CAS Name

2-[(2,2,2-Trifluoroethyl)thio]benzoic acid

Molecular Formula

C9H7F3O2S

Molecular Mass

236.21

Cite this Page

2-[(2,2,2-Trifluoroethyl)thio]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=162965-55-1 (retrieved 2024-08-11) (CAS RN: 162965-55-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H7F3O2S/c10-9(11,12)5-15-7-4-2-1-3-6(7)8(13)14/h1-4H,5H2,(H,13,14)

InChIKey

InChIKey=OCTLXWNDUQYRCZ-UHFFFAOYSA-N

SMILES

S(CC(F)(F)F)C1=C(C(O)=O)C=CC=C1

Canonical SMILES

O=C(O)C=1C=CC=CC1SCC(F)(F)F

Other Names for this Substance

  • Benzoic acid, 2-[(2,2,2-trifluoroethyl)thio]-
  • 2-[(2,2,2-Trifluoroethyl)thio]benzoic acid
  • 2-[(2,2,2-Trifluoroethyl)sulfanyl]benzoic acid