Molecule ID: 9963

IUPAC Name: 3-(trifluoromethyl)benzoic acid

Description: The molecule is a benzoic acid carrying a trifluoromethyl substituent at the 3-position. It is a member of benzoic acids and a member of (trifluoromethyl)benzenes.

SMILES: O=C(O)c1cccc(C(F)(F)F)c1

SELFIES: [O][=C][Branch1][C][O][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2]

InChI: InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)

Molecular Properties:
- Polar Surface Area: 37.3 Ų
- LogP: 3.0