Molecule ID: 441114

IUPAC Name: 3-chloro-6-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene-1,2-diol

Description: The molecule is a member of monochlorobenzenes, a member of catechols and a chlorophenylethylene. It has a role as a mouse metabolite.

SMILES: Oc1c(Cl)ccc(C(=C(Cl)Cl)c2ccc(Cl)cc2)c1O

SELFIES: [O][C][=C][Branch1][C][Cl][C][=C][C][Branch2][Ring1][Ring2][C][=Branch1][=Branch1][=C][Branch1][C][Cl][Cl][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][Ring2][Ring1][C][O]

InChI: InChI=1S/C14H8Cl4O2/c15-8-3-1-7(2-4-8)11(14(17)18)9-5-6-10(16)13(20)12(9)19/h1-6,19-20H

Molecular Properties:
- Polar Surface Area: 40.5 Ų
- LogP: 6.2