1.0 2010-04-08 22:08:31 UTC 2025-11-18 23:15:44 UTC FDB009325 (+/-)-trans- and cis-4,8-Dimethyl-3,7-nonadien-2-yl acetate It is used as a food additive . C13H22O2 210.317 210.161979948 4,8-dimethylnona-3,7-dien-2-yl acetate 4,8-dimethylnona-3,7-dien-2-yl acetate 91418-25-6 CC(OC(C)=O)C=C(C)CCC=C(C)C InChI=1S/C13H22O2/c1-10(2)7-6-8-11(3)9-12(4)15-13(5)14/h7,9,12H,6,8H2,1-5H3 AZPPBYINNXLPQZ-UHFFFAOYSA-N belongs to the class of organic compounds known as fatty alcohol esters. These are ester derivatives of a fatty alcohol. Fatty alcohol esters Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty alcohol esters Aliphatic acyclic compounds Acyclic monoterpenoids Carbonyl compounds Carboxylic acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Acyclic monoterpenoid Aliphatic acyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Fatty alcohol ester Hydrocarbon derivative Monocarboxylic acid or derivatives Monoterpenoid Organic oxide Organic oxygen compound Organooxygen compound logp 4.41 ALOGPS logs -3.30 ALOGPS solubility 1.05e-01 g/l ALOGPS logp 3.36 ChemAxon pka_strongest_basic -7 ChemAxon iupac 4,8-dimethylnona-3,7-dien-2-yl acetate ChemAxon average_mass 210.317 ChemAxon mono_mass 210.161979948 ChemAxon smiles CC(OC(C)=O)C=C(C)CCC=C(C)C ChemAxon formula C13H22O2 ChemAxon inchi InChI=1S/C13H22O2/c1-10(2)7-6-8-11(3)9-12(4)15-13(5)14/h7,9,12H,6,8H2,1-5H3 ChemAxon inchikey AZPPBYINNXLPQZ-UHFFFAOYSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 64.75 ChemAxon polarizability 25.21 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 68433 Specdb::MsMs 68434 Specdb::MsMs 68435 Specdb::MsMs 126462 Specdb::MsMs 126463 Specdb::MsMs 126464 Specdb::MsMs 3604921 Specdb::MsMs 3604922 Specdb::MsMs 3604923 Specdb::MsMs 3604924 Specdb::MsMs 3604925 Specdb::MsMs 3604926 citrus earthy lemon rind woody