Molecule ID: 3

IUPAC Name: 5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid

Description: The molecule is a cyclohexadienecarboxylic acid having the C=C bonds at the 1- and 3-positions, the carboxylic acid at the 1-position and two hydroxy substituents at the 5- and 6-positions. It is a cyclohexadienecarboxylic acid and an alpha,beta-unsaturated monocarboxylic acid. It is a conjugate acid of a 2,3-dihydroxy-2,3-dihydrobenzoate.

SMILES: O=C(O)C1=CC=CC(O)C1O

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

InChI: InChI=1S/C7H8O4/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,5-6,8-9H,(H,10,11)

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