Molecule ID: 328

IUPAC Name: 2-hydroxy-2-(4-hydroxyphenyl)acetic acid

Description: The molecule is a 2-hydroxy carboxylic acid that is mandelic acid bearing a phenolic hydroxy substituent at position 4. It has a role as a metabolite. It is a 2-hydroxy carboxylic acid and a member of phenols. It derives from a mandelic acid. It is a conjugate acid of a 4-hydroxymandelate.

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

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

InChI: InChI=1S/C8H8O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)

Molecular Properties:
- Polar Surface Area: 77.8 Ų
- LogP: 0.3