1.0 2016-05-19 02:45:36 UTC 2026-08-23 11:17:47 UTC 4-Chlorocatechol SmallMolecule 4-Chlorocatechol is an organic compound with the formula C6H5ClO2 and an average molecular weight of 144.56 g/mol. 4-Chlorocatechol belongs to the benzenediols, a subclass of phenols within the organic compounds. This benzenoid compound is found in or released from one recorded source: household cleaning and consumer products, specifically soap detergents. C6H5ClO2 144.556 143.997807111 4-chlorobenzene-1,2-diol 4-chlorocatechol 2138-22-9 OC1=C(O)C=C(Cl)C=C1 InChI=1S/C6H5ClO2/c7-4-1-2-5(8)6(9)3-4/h1-3,8-9H WWOBYPKUYODHDG-UHFFFAOYSA-N Organic compounds Benzenoids Phenols Benzenediols 4-chlorocatechols 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Aryl chlorides Chlorobenzenes Hydrocarbon derivatives M-chlorophenols Organochlorides Organooxygen compounds P-chlorophenols 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 3-chlorophenol 3-halophenol 4-chlorocatechol 4-chlorophenol 4-halophenol Aromatic homomonocyclic compound Aryl chloride Aryl halide Chlorobenzene Halobenzene Hydrocarbon derivative Monocyclic benzene moiety Organic oxygen compound Organochloride Organohalogen compound Organooxygen compound Aromatic homomonocyclic compounds a catechol a chloroaromatic compound chlorocatechol monochlorobenzenes Detected and Not Quantified logp 2.3 logp 1.61 ALOGPS logs -0.70 ALOGPS solubility 2.87e+01 g/l ALOGPS logp 1.97 ChemAxon pka_strongest_acidic 8.67 ChemAxon pka_strongest_basic -6.6 ChemAxon iupac 4-chlorobenzene-1,2-diol ChemAxon average_mass 144.556 ChemAxon mono_mass 143.997807111 ChemAxon smiles OC1=C(O)C=C(Cl)C=C1 ChemAxon formula C6H5ClO2 ChemAxon inchi InChI=1S/C6H5ClO2/c7-4-1-2-5(8)6(9)3-4/h1-3,8-9H ChemAxon inchikey WWOBYPKUYODHDG-UHFFFAOYSA-N ChemAxon polar_surface_area 40.46 ChemAxon refractivity 34.82 ChemAxon polarizability 12.92 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f72257b53d8> 16496 15638