Molecule ID: 3848

IUPAC Name: 2-hydroxy-3-phenylpropanoic acid

Description: The molecule is a 2-hydroxy monocarboxylic acid that is lactic acid in which one of the methyl hydrogens is substituted by a phenyl group. It has a role as a human metabolite. It derives from a rac-lactic acid. It is a conjugate acid of a 3-phenyllactate.

SMILES: O=C(O)C(O)Cc1ccccc1

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

InChI: InChI=1S/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)

Molecular Properties:
- Polar Surface Area: 57.5 Ų
- LogP: 1.1