1.0 2010-04-08 22:11:09 UTC 2025-11-19 00:44:34 UTC FDB014225 11,13-Triacontanedione Constituent of the pollen of Helianthus annuus (sunflower). 11,13-Triacontanedione is found in fats and oils. C30H58O2 450.7803 450.4436811 triacontane-11,13-dione triacontane-11,13-dione CCCCCCCCCCCCCCCCCC(=O)CC(=O)CCCCCCCCCC InChI=1S/C30H58O2/c1-3-5-7-9-11-13-14-15-16-17-18-19-21-23-25-27-30(32)28-29(31)26-24-22-20-12-10-8-6-4-2/h3-28H2,1-2H3 DNAGKLQHEJMYRQ-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 9.85 ALOGPS logs -7.41 ALOGPS solubility 1.76e-05 g/l ALOGPS logp 11.95 ChemAxon pka_strongest_acidic 7.81 ChemAxon pka_strongest_basic -7.2 ChemAxon iupac triacontane-11,13-dione ChemAxon average_mass 450.7803 ChemAxon mono_mass 450.4436811 ChemAxon smiles CCCCCCCCCCCCCCCCCC(=O)CC(=O)CCCCCCCCCC ChemAxon formula C30H58O2 ChemAxon inchi InChI=1S/C30H58O2/c1-3-5-7-9-11-13-14-15-16-17-18-19-21-23-25-27-30(32)28-29(31)26-24-22-20-12-10-8-6-4-2/h3-28H2,1-2H3 ChemAxon inchikey DNAGKLQHEJMYRQ-UHFFFAOYSA-N ChemAxon polar_surface_area 34.14 ChemAxon refractivity 141.17 ChemAxon polarizability 62.11 ChemAxon rotatable_bond_count 27 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 15636 Specdb::CMs 133048 Specdb::CMs 140782 Specdb::MsMs 73092 Specdb::MsMs 73093 Specdb::MsMs 73094 Specdb::MsMs 132177 Specdb::MsMs 132178 Specdb::MsMs 132179 Specdb::MsMs 2352412 Specdb::MsMs 2352413 Specdb::MsMs 2352414 Specdb::MsMs 2583338 Specdb::MsMs 2583339 Specdb::MsMs 2583340 HMDB35533 #<Reference:0x000055ce32dba668> Fats and oils Unknown generic