1.0 2010-04-08 22:12:19 UTC 2025-11-19 01:45:39 UTC FDB016233 Citronellyl propionate Flavouring ingredient. Constituent of tomato. Citronellyl propionate is found in garden tomato. (+)-3,7-Dimethyloct-6-enyl propionate (1)-3,7-Dimethyloct-6-enyl propionate 3,7-Dimethyl-6-octen-1-ol propanoate 3,7-Dimethyl-6-octen-1-yl propanoate 3,7-Dimethyl-6-octen-1-yl propionate 3,7-Dimethyl-6-octenyl propionate 6-Octen-1-ol, 3,7-dimethyl-, 1-propanoate 6-Octen-1-ol, 3,7-dimethyl-, propanoate 6-Octen-1-ol, 3,7-dimethyl-, propionate 6-Octen-1-ol, 3,7-dimethyl-, propionate (7CI,8CI) Citronellyl n-proprionate Citronellyl propanoate Citronellyl propianoate Citronellyl propionate E410 FEMA 2316 Methyl diphenylite Methyl diphenylphosphite Propionic acid, ester with citronellol Propionic acid, ester with citronellol (6CI) C13H24O2 212.3285 212.177630012 3,7-dimethyloct-6-en-1-yl propanoate 3,7-dimethyloct-6-en-1-yl propanoate 141-14-0 CCC(=O)OCCC(C)CCC=C(C)C InChI=1S/C13H24O2/c1-5-13(14)15-10-9-12(4)8-6-7-11(2)3/h7,12H,5-6,8-10H2,1-4H3 POPNTVRHTZDEBW-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 4.54 ALOGPS logs -3.87 ALOGPS solubility 2.85e-02 g/l ALOGPS logp 3.89 ChemAxon pka_strongest_basic -7 ChemAxon iupac 3,7-dimethyloct-6-en-1-yl propanoate ChemAxon average_mass 212.3285 ChemAxon mono_mass 212.177630012 ChemAxon smiles CCC(=O)OCCC(C)CCC=C(C)C ChemAxon formula C13H24O2 ChemAxon inchi InChI=1S/C13H24O2/c1-5-13(14)15-10-9-12(4)8-6-7-11(2)3/h7,12H,5-6,8-10H2,1-4H3 ChemAxon inchikey POPNTVRHTZDEBW-UHFFFAOYSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 64.26 ChemAxon polarizability 26.47 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 1808 Specdb::CMs 15099 Specdb::CMs 28519 Specdb::CMs 101862 Specdb::CMs 157524 Specdb::MsMs 89667 Specdb::MsMs 89668 Specdb::MsMs 89669 Specdb::MsMs 152640 Specdb::MsMs 152641 Specdb::MsMs 152642 Specdb::MsMs 2426101 Specdb::MsMs 2426102 Specdb::MsMs 2426103 Specdb::MsMs 2509315 Specdb::MsMs 2509316 Specdb::MsMs 2509317 HMDB37226 #<Reference:0x000055ce32457ad0> Garden tomato Type 1 specific Solanum lycopersicum 4081 bitter floral fruity green neroli rose waxy