Molecule ID: 177281

IUPAC Name: 3-chloro-4-methylbenzene-1,2-diol

Description: The molecule is a chlorocatechol that is catechol which is substituted by a chlorine at position 3 and a methyl group at position 4. It is a methylcatechol, a chlorocatechol and a member of monochlorobenzenes. It derives from a 4-methylcatechol.

SMILES: Cc1ccc(O)c(O)c1Cl

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

InChI: InChI=1S/C7H7ClO2/c1-4-2-3-5(9)7(10)6(4)8/h2-3,9-10H,1H3

Molecular Properties:
- Polar Surface Area: 40.5 Ų
- LogP: 2.2