1.0 2016-06-03 13:40:20 UTC 2026-08-20 06:11:28 UTC 2-(2H-Benzotriazol-2-yl)-4,6-di-tert-butylphenol SmallMolecule 2-(2H-Benzotriazol-2-yl)-4,6-di-tert-butylphenol is an organic compound with the formula C20H25N3O and an average molecular weight of 323.44 g/mol. 2-(2H-Benzotriazol-2-yl)-4,6-di-tert-butylphenol belongs to the triazoles, a subclass of azoles within the organic compounds. Industrially, this compound is utilized as a UV stabilizer. It has been identified in 11 recorded sources, including household items such as credit card holders and food, food processing, and cookware, specifically in food contact materials and the processing of fish. It is also found in electrical and electronic equipment, including antennas, auxiliary devices, coils, communication cables or conductors, and discharge lamps, among three other sources. Recorded exposure routes for the compound include inhalation, oral intake, and touch. Tertiary butyl phenols C20H25N3O 323.44 323.199762437 2-(2H-1,2,3-benzotriazol-2-yl)-4,6-di-tert-butylphenol 2-(1,2,3-benzotriazol-2-yl)-4,6-di-tert-butylphenol 3846-71-7 CC(C)(C)C1=CC(=C(O)C(=C1)N1N=C2C=CC=CC2=N1)C(C)(C)C InChI=1S/C20H25N3O/c1-19(2,3)13-11-14(20(4,5)6)18(24)17(12-13)23-21-15-9-7-8-10-16(15)22-23/h7-12,24H,1-6H3 LHPPDQUVECZQSW-UHFFFAOYSA-N Organic compounds Organoheterocyclic compounds Azoles Triazoles Phenyl-1,2,3-triazoles Azacyclic compounds Benzotriazoles Heteroaromatic compounds Hydrocarbon derivatives Organonitrogen compounds Organooxygen compounds Organopnictogen compounds Phenols Phenylpropanes Aromatic heteropolycyclic compound Azacycle Benzenoid Benzotriazole Heteroaromatic compound Hydrocarbon derivative Monocyclic benzene moiety Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenol Phenyl-1,2,3-triazole Phenylpropane Aromatic heteropolycyclic compounds Detected and Not Quantified logp 7.3 logp 5.63 ALOGPS logs -4.71 ALOGPS solubility 6.27e-03 g/l ALOGPS logp 5.97 ChemAxon pka_strongest_acidic 10.2 ChemAxon pka_strongest_basic -0.38 ChemAxon iupac 2-(2H-1,2,3-benzotriazol-2-yl)-4,6-di-tert-butylphenol ChemAxon average_mass 323.44 ChemAxon mono_mass 323.199762437 ChemAxon smiles CC(C)(C)C1=CC(=C(O)C(=C1)N1N=C2C=CC=CC2=N1)C(C)(C)C ChemAxon formula C20H25N3O ChemAxon inchi InChI=1S/C20H25N3O/c1-19(2,3)13-11-14(20(4,5)6)18(24)17(12-13)23-21-15-9-7-8-10-16(15)22-23/h7-12,24H,1-6H3 ChemAxon inchikey LHPPDQUVECZQSW-UHFFFAOYSA-N ChemAxon polar_surface_area 50.94 ChemAxon refractivity 108.69 ChemAxon polarizability 37.91 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7226e119b0> 77455 69864