Molecule ID: 5443

IUPAC Name: 2-sulfanylbenzoic acid

Description: The molecule is a sulfanylbenzoic acid that is the 2-sulfanyl derivative of benzoic acid. It has a role as a non-narcotic analgesic and an antipyretic. It is a conjugate acid of a thiosalicylate(1-).

SMILES: O=C(O)c1ccccc1S

SELFIES: [O][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][S]

InChI: InChI=1S/C7H6O2S/c8-7(9)5-3-1-2-4-6(5)10/h1-4,10H,(H,8,9)

Molecular Properties:
- Polar Surface Area: 38.3 Ų
- LogP: 2.4