Molecule ID: 9966

IUPAC Name: 4-(trifluoromethyl)benzoic acid

Description: The molecule is a benzoic acid carrying a 4-trifluoromethyl substituent. It is a member of benzoic acids and a member of (trifluoromethyl)benzenes.

SMILES: O=C(O)c1ccc(C(F)(F)F)cc1

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

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

Molecular Properties:
- Polar Surface Area: 37.3 Ų
- LogP: 3.1