1.0 2016-05-22 05:48:14 UTC 2026-05-14 19:51:58 UTC Climbazole SmallMolecule Climbazole is an organic compound with the chemical formula C15H17ClN2O2 and an average molecular weight of 292.76 g/mol. Climbazole belongs to the phenol ethers, a class of benzenoids within the organic compounds. Industrially, the substance is utilized as a biocide, a preservative, and an anti-dandruff agent. The compound has been identified in 20 recorded sources across multiple sectors. Within drinking water and water supply systems, it is found in tap water, bottled water, desalinated water, and drinking water. In aquatic systems and sediments, it occurs in freshwater, seawater, groundwater, and surface water. It is also present in wastewater, sanitation, and biosolids, including industrial wastewater, mine wastewater, wastewater treatment effluent, and unspecified wastewater. Additionally, climbazole is found in appliances, HVAC, and refrigerants, specifically in water heaters and water coolers. In the marine, shipping, and aquaculture sector, it is recorded in bilge water and ballast water, while irrigation water represents its presence in agriculture and land management. It has also been detected in three other sectors. Recorded routes of exposure for this compound include touch, oral, and inhalation. PMT 2-Butanone, 1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethyl- C15H17ClN2O2 292.76 292.0978555 1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one climbazole 38083-17-9 CC(C)(C)C(=O)C(OC1=CC=C(Cl)C=C1)N1C=CN=C1 InChI=1S/C15H17ClN2O2/c1-15(2,3)13(19)14(18-9-8-17-10-18)20-12-6-4-11(16)5-7-12/h4-10,14H,1-3H3 OWEGWHBOCFMBLP-UHFFFAOYSA-N Organic compounds Benzenoids Phenol ethers Phenol ethers Aryl chlorides Azacyclic compounds Chlorobenzenes Heteroaromatic compounds Hydrocarbon derivatives Ketones N-substituted imidazoles Organic oxides Organochlorides Organonitrogen compounds Organopnictogen compounds Phenoxy compounds Aromatic heteromonocyclic compound Aryl chloride Aryl halide Azacycle Azole Carbonyl group Chlorobenzene Halobenzene Heteroaromatic compound Hydrocarbon derivative Imidazole Ketone Monocyclic benzene moiety N-substituted imidazole Organic nitrogen compound Organic oxide Organic oxygen compound Organochloride Organohalogen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenol ether Phenoxy compound Aromatic heteromonocyclic compounds aromatic ether imidazoles ketone monochlorobenzenes Detected and Not Quantified logp 4.34 logp 3.33 ALOGPS logs -3.69 ALOGPS solubility 5.95e-02 g/l ALOGPS logp 4.34 ChemAxon pka_strongest_acidic 18.87 ChemAxon pka_strongest_basic 6.49 ChemAxon iupac 1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one ChemAxon average_mass 292.76 ChemAxon mono_mass 292.0978555 ChemAxon smiles CC(C)(C)C(=O)C(OC1=CC=C(Cl)C=C1)N1C=CN=C1 ChemAxon formula C15H17ClN2O2 ChemAxon inchi InChI=1S/C15H17ClN2O2/c1-15(2,3)13(19)14(18-9-8-17-10-18)20-12-6-4-11(16)5-7-12/h4-10,14H,1-3H3 ChemAxon inchikey OWEGWHBOCFMBLP-UHFFFAOYSA-N ChemAxon polar_surface_area 44.12 ChemAxon refractivity 77.51 ChemAxon polarizability 29.76 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bae287580> DB15580 37907 34752