Molecule ID: 64

IUPAC Name: 2,5-dichlorocyclohexa-2,5-diene-1,4-diol

Description: The molecule is a cyclohexadienediol that is cyclohexa-2,5-diene-1,4-diol in which positions 2 and 5 are substituted by chlorines. It has a role as a bacterial xenobiotic metabolite. It is an organochlorine compound, an organic hydroxy compound and a cyclohexadienediol.

SMILES: OC1C=C(Cl)C(O)C=C1Cl

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

InChI: InChI=1S/C6H6Cl2O2/c7-3-1-5(9)4(8)2-6(3)10/h1-2,5-6,9-10H

Molecular Properties:
- Polar Surface Area: 40.5 Ų
- LogP: 0.6