Molecule ID: 67874

IUPAC Name: 4-(trifluoromethyl)phenol

Description: The molecule is a member of the class of (trifluoromethyl)benzenes that is p-cresol in which the methyl group is perfluorinated. It is a metabolite of the drug fluoxetine. It has a role as a marine xenobiotic metabolite and a drug metabolite. It is a member of phenols and a member of (trifluoromethyl)benzenes. It derives from a (trifluoromethyl)benzene and a p-cresol.

SMILES: Oc1ccc(C(F)(F)F)cc1

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

InChI: InChI=1S/C7H5F3O/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4,11H

Molecular Properties:
- Polar Surface Area: 20.2 Ų
- LogP: 2.8