Molecule ID: 71728459

IUPAC Name: (3R,4R)-3,4-dihydroxycyclohexa-1,5-diene-1-carboxylate

Description: The molecule is a hydroxy monocarboxylic acid anion that is the conjugate base of (3R,4R)-3,4-dihydroxycyclohexa-1,5-diene-1-carboxylic acid, obtained by deprotonation of the carboxy group. It is a conjugate base of a (3R,4R)-3,4-dihydroxycyclohexa-1,5-diene-1-carboxylic acid.

SMILES: O=C([O-])C1=C[C@@H](O)[C@H](O)C=C1

SELFIES: [O][=C][Branch1][C][O-1][C][=C][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C][=C][Ring1][Branch2]

InChI: InChI=1S/C7H8O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,5-6,8-9H,(H,10,11)/p-1/t5-,6-/m1/s1

Molecular Properties:
- Polar Surface Area: 80.6 Ų
- LogP: -0.2