Molecule ID: 151011

IUPAC Name: 2-hydroxycyclohexa-2,5-diene-1,4-dione

Description: The molecule is the simplest member of the class of 2-hydroxy-1,4-benzoquinones, that is 1,4-benzoquinone in which a single hydrogen is replaced by a hydroxy group. It has a role as a mouse metabolite. It is a conjugate acid of a 3,6-dioxocyclohexa-1,4-dien-1-olate.

SMILES: O=C1C=CC(=O)C(O)=C1

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

InChI: InChI=1S/C6H4O3/c7-4-1-2-5(8)6(9)3-4/h1-3,9H

Molecular Properties:
- Polar Surface Area: 54.4 Ų
- LogP: 0.2