1.0 2010-04-08 22:09:14 UTC 2019-11-26 03:03:58 UTC FDB010674 3,4',5-Biphenyltriol Constituent of Trifolium repens (white clover). 3,4',5-Biphenyltriol is found in tea, herbs and spices, and green vegetables. 3,4',5-Trihydroxybiphenyl C12H10O3 202.206 202.062994186 5-(4-hydroxyphenyl)benzene-1,3-diol 5-(4-hydroxyphenyl)benzene-1,3-diol 74276-54-3 OC1=CC=C(C=C1)C1=CC(O)=CC(O)=C1 InChI=1S/C12H10O3/c13-10-3-1-8(2-4-10)9-5-11(14)7-12(15)6-9/h1-7,13-15H HSZOQEGJICWJDP-UHFFFAOYSA-N belongs to the class of organic compounds known as biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond. Biphenyls and derivatives Organic compounds Benzenoids Benzene and substituted derivatives Biphenyls and derivatives Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Hydrocarbon derivatives Organooxygen compounds Resorcinols 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Aromatic homomonocyclic compound Biphenyl Hydrocarbon derivative Organic oxygen compound Organooxygen compound Phenol Resorcinol logp 1.94 ALOGPS logs -2.77 ALOGPS solubility 3.40e-01 g/l ALOGPS logp 2.71 ChemAxon pka_strongest_acidic 9.02 ChemAxon pka_strongest_basic -5.5 ChemAxon iupac 5-(4-hydroxyphenyl)benzene-1,3-diol ChemAxon average_mass 202.206 ChemAxon mono_mass 202.062994186 ChemAxon smiles OC1=CC=C(C=C1)C1=CC(O)=CC(O)=C1 ChemAxon formula C12H10O3 ChemAxon inchi InChI=1S/C12H10O3/c13-10-3-1-8(2-4-10)9-5-11(14)7-12(15)6-9/h1-7,13-15H ChemAxon inchikey HSZOQEGJICWJDP-UHFFFAOYSA-N ChemAxon polar_surface_area 60.69 ChemAxon refractivity 57.14 ChemAxon polarizability 20.93 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 3 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 5695 Specdb::MsIr 5696 Specdb::MsIr 5697 Specdb::CMs 16347 Specdb::CMs 42929 Specdb::CMs 164685 Specdb::MsMs 45174 Specdb::MsMs 45175 Specdb::MsMs 45176 Specdb::MsMs 170790 Specdb::MsMs 170791 Specdb::MsMs 170792 Specdb::MsMs 2267079 Specdb::MsMs 2267080 Specdb::MsMs 2267081 Specdb::MsMs 3071187 Specdb::MsMs 3071188 Specdb::MsMs 3071189 HMDB32713 #<Reference:0x000055ce31c89b00> Black tea Type 1 Green tea Type 1 Green vegetables Unknown generic Herbal tea Type 1 Herbs and Spices Unknown generic Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442