1.0 2010-04-08 22:11:10 UTC 2019-11-26 03:09:45 UTC FDB014270 10,12-Tritriacontanedione Constituent of the pollen of Helianthus annuus (sunflower). 10,12-Tritriacontanedione is found in fats and oils. C33H64O2 492.8601 492.490631292 tritriacontane-10,12-dione tritriacontane-10,12-dione CCCCCCCCCCCCCCCCCCCCCC(=O)CC(=O)CCCCCCCCC InChI=1S/C33H64O2/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-24-26-28-30-33(35)31-32(34)29-27-25-23-10-8-6-4-2/h3-31H2,1-2H3 FMVLYJUATISDME-UHFFFAOYSA-N belongs to the class of organic compounds known as beta-diketones. These are organic compounds containing two keto groups separated by a single carbon atom. Beta-diketones Organic compounds Organic oxygen compounds Organooxygen compounds Carbonyl compounds Aliphatic acyclic compounds Hydrocarbon derivatives Ketones Organic oxides 1,3-diketone Aliphatic acyclic compound Hydrocarbon derivative Ketone Organic oxide logp 10.28 ALOGPS logs -7.54 ALOGPS solubility 1.42e-05 g/l ALOGPS logp 13.29 ChemAxon pka_strongest_acidic 7.81 ChemAxon pka_strongest_basic -7.2 ChemAxon iupac tritriacontane-10,12-dione ChemAxon average_mass 492.8601 ChemAxon mono_mass 492.490631292 ChemAxon smiles CCCCCCCCCCCCCCCCCCCCCC(=O)CC(=O)CCCCCCCCC ChemAxon formula C33H64O2 ChemAxon inchi InChI=1S/C33H64O2/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-24-26-28-30-33(35)31-32(34)29-27-25-23-10-8-6-4-2/h3-31H2,1-2H3 ChemAxon inchikey FMVLYJUATISDME-UHFFFAOYSA-N ChemAxon polar_surface_area 34.14 ChemAxon refractivity 154.97 ChemAxon polarizability 68.57 ChemAxon rotatable_bond_count 30 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 18595 Specdb::CMs 162303 Specdb::MsMs 109800 Specdb::MsMs 109801 Specdb::MsMs 109802 Specdb::MsMs 177321 Specdb::MsMs 177322 Specdb::MsMs 177323 Specdb::MsMs 2380710 Specdb::MsMs 2380711 Specdb::MsMs 2380712 Specdb::MsMs 2558232 Specdb::MsMs 2558233 Specdb::MsMs 2558234 HMDB35578 #<Reference:0x000055ce30747bc0> Fats and oils Unknown generic