1.0 2010-04-08 22:08:15 UTC 2019-11-26 03:03:10 UTC FDB008774 Butyl dodecanoate Present in apple, papaya, cape gooseberry, spineless monkey orange and malt whisky. It is used in fruit flavouring. Butyl dodecanoate is found in alcoholic beverages, pomes, and fruits. Butyl dodecanoate Butyl dodecylate Butyl laurate BYTYL laurate Dodecanoic acid, butyl ester FEMA 2206 Lauric acid butyl ester Lauric acid n-butyl ester Lauric acid, butyl ester Lauric acid, butyl ester (8CI) N-butyl laurate N-butyl n-dodecanoate C16H32O2 256.4241 256.240230268 butyl dodecanoate dodecanoic acid, butyl ester 106-18-3 CCCCCCCCCCCC(=O)OCCCC InChI=1S/C16H32O2/c1-3-5-7-8-9-10-11-12-13-14-16(17)18-15-6-4-2/h3-15H2,1-2H3 NDKYEUQMPZIGFN-UHFFFAOYSA-N belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid. Fatty acid esters Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acid esters Aliphatic acyclic compounds Carbonyl compounds Carboxylic acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Aliphatic acyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Fatty acid ester Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Liquid logp 6.61 ALOGPS logs -6.08 ALOGPS solubility 2.14e-04 g/l ALOGPS melting_point Mp -7° logp 5.95 ChemAxon pka_strongest_basic -7 ChemAxon iupac butyl dodecanoate ChemAxon average_mass 256.4241 ChemAxon mono_mass 256.240230268 ChemAxon smiles CCCCCCCCCCCC(=O)OCCCC ChemAxon formula C16H32O2 ChemAxon inchi InChI=1S/C16H32O2/c1-3-5-7-8-9-10-11-12-13-14-16(17)18-15-6-4-2/h3-15H2,1-2H3 ChemAxon inchikey NDKYEUQMPZIGFN-UHFFFAOYSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 77.32 ChemAxon polarizability 34.13 ChemAxon rotatable_bond_count 14 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21071 Specdb::CMs 27494 Specdb::CMs 28396 Specdb::CMs 29758 Specdb::CMs 29786 Specdb::CMs 29787 Specdb::CMs 101032 Specdb::CMs 101033 Specdb::CMs 101034 Specdb::CMs 101035 Specdb::CMs 101036 Specdb::CMs 156582 Specdb::MsMs 99627 Specdb::MsMs 99628 Specdb::MsMs 99629 Specdb::MsMs 164796 Specdb::MsMs 164797 Specdb::MsMs 164798 Specdb::MsMs 2395584 Specdb::MsMs 2395585 Specdb::MsMs 2395586 Specdb::MsMs 2539292 Specdb::MsMs 2539293 Specdb::MsMs 2539294 HMDB32065 #<Reference:0x000055ce33270e78> Alcoholic beverages Unknown generic Fruits Unknown generic Pomes Unknown generic fruity oil oily peanut soapy waxy