1.0 2010-04-08 22:11:15 UTC 2019-11-26 03:09:58 UTC FDB014396 3-Hydroxy-1-phenyl-1-octadecanone Constituent of the pollen of Helianthus annuus (sunflower). 3-Hydroxy-1-phenyl-1-octadecanone is found in fats and oils. 1-Benzoyl-2-heptadecanol 3-Hydroxy-1-phenyl-1-octadecanone C24H40O2 360.5732 360.302830524 3-hydroxy-1-phenyloctadecan-1-one 3-hydroxy-1-phenyloctadecan-1-one CCCCCCCCCCCCCCCC(O)CC(=O)C1=CC=CC=C1 InChI=1S/C24H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-23(25)21-24(26)22-18-15-14-16-19-22/h14-16,18-19,23,25H,2-13,17,20-21H2,1H3 AESWPUVMLJHDRW-UHFFFAOYSA-N belongs to the class of organic compounds known as long-chain fatty alcohols. These are fatty alcohols that have an aliphatic tail of 13 to 21 carbon atoms. Long-chain fatty alcohols Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty alcohols Aromatic homomonocyclic compounds Alkyl-phenylketones Aryl alkyl ketones Benzoyl derivatives Beta-hydroxy ketones Butyrophenones Hydrocarbon derivatives Organic oxides Secondary alcohols Alcohol Alkyl-phenylketone Aromatic homomonocyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Benzoyl Beta-hydroxy ketone Butyrophenone Hydrocarbon derivative Ketone Long chain fatty alcohol Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Phenylketone Secondary alcohol logp 7.92 ALOGPS logs -6.74 ALOGPS solubility 6.63e-05 g/l ALOGPS logp 7.67 ChemAxon pka_strongest_acidic 14.82 ChemAxon pka_strongest_basic -2.8 ChemAxon iupac 3-hydroxy-1-phenyloctadecan-1-one ChemAxon average_mass 360.5732 ChemAxon mono_mass 360.302830524 ChemAxon smiles CCCCCCCCCCCCCCCC(O)CC(=O)C1=CC=CC=C1 ChemAxon formula C24H40O2 ChemAxon inchi InChI=1S/C24H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-23(25)21-24(26)22-18-15-14-16-19-22/h14-16,18-19,23,25H,2-13,17,20-21H2,1H3 ChemAxon inchikey AESWPUVMLJHDRW-UHFFFAOYSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 111.62 ChemAxon polarizability 47.09 ChemAxon rotatable_bond_count 17 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10243 Specdb::CMs 44499 Specdb::CMs 133058 Specdb::CMs 140792 Specdb::MsMs 47484 Specdb::MsMs 47485 Specdb::MsMs 47486 Specdb::MsMs 154605 Specdb::MsMs 154606 Specdb::MsMs 154607 Specdb::MsMs 2704106 Specdb::MsMs 2704107 Specdb::MsMs 2704108 Specdb::MsMs 3002089 Specdb::MsMs 3002090 Specdb::MsMs 3002091 HMDB35680 #<Reference:0x000055ce31eeeb98> Fats and oils Unknown generic