Molecule ID: 7322

IUPAC Name: 2-hydroxy-5-sulfobenzoic acid

Description: The molecule is an arenesulfonic acid that is benzoic acid substituted by a hydroxy at position C-2 and a sulfo group at C-5. It has a role as a metabolite. It is an arenesulfonic acid, a member of benzoic acids and a member of phenols. It derives from a benzoic acid and a phenol.

SMILES: O=C(O)c1cc(S(=O)(=O)O)ccc1O

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

InChI: InChI=1S/C7H6O6S/c8-6-2-1-4(14(11,12)13)3-5(6)7(9)10/h1-3,8H,(H,9,10)(H,11,12,13)

Molecular Properties:
- Polar Surface Area: 120.0 Ų
- LogP: 1.3