1.0 2010-04-08 22:09:41 UTC 2015-07-20 22:41:08 UTC FDB011520 Geranyl benzoate Flavouring ingredient (2,4-dimethylphenyl)methanamine (2E)-3,7-Dimethyl-2,6-octadienyl benzoate 2,4-Dimethyl-benzenemethanamine 2,4-Dimethyl-benzylamine 2,4-DIMETHYLBENZYLAMINE Benzenemethanamine, 2,4-dimethyl- Benzylamine, 2,4-dimethyl- FEMA 2511 Geranyl benzoate C17H22O2 258.3554 258.161979948 (2Z)-3,7-dimethylocta-2,6-dien-1-yl benzoate (2Z)-3,7-dimethylocta-2,6-dien-1-yl benzoate 94-48-4 CC(C)=CCC\C(C)=C/COC(=O)C1=CC=CC=C1 InChI=1S/C17H22O2/c1-14(2)8-7-9-15(3)12-13-19-17(18)16-10-5-4-6-11-16/h4-6,8,10-12H,7,9,13H2,1-3H3/b15-12- YDVXYTIIPGKIJP-QINSGFPZSA-N belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring. Aromatic monoterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Aromatic homomonocyclic compounds Benzoic acid esters Benzoyl derivatives Carboxylic acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Monocyclic monoterpenoids Organic oxides Organooxygen compounds Aromatic homomonocyclic compound Aromatic monoterpenoid Benzenoid Benzoate ester Benzoic acid or derivatives Benzoyl Carboxylic acid derivative Carboxylic acid ester Hydrocarbon derivative Monocarboxylic acid or derivatives Monocyclic benzene moiety Monocyclic monoterpenoid Organic oxide Organic oxygen compound Organooxygen compound logp 5.70 ALOGPS logs -4.40 ALOGPS solubility 1.02e-02 g/l ALOGPS logp 5 ChemAxon pka_strongest_basic -6.9 ChemAxon iupac (2Z)-3,7-dimethylocta-2,6-dien-1-yl benzoate ChemAxon average_mass 258.3554 ChemAxon mono_mass 258.161979948 ChemAxon smiles CC(C)=CCC\C(C)=C/COC(=O)C1=CC=CC=C1 ChemAxon formula C17H22O2 ChemAxon inchi InChI=1S/C17H22O2/c1-14(2)8-7-9-15(3)12-13-19-17(18)16-10-5-4-6-11-16/h4-6,8,10-12H,7,9,13H2,1-3H3/b15-12- ChemAxon inchikey YDVXYTIIPGKIJP-QINSGFPZSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 81 ChemAxon polarizability 30.33 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 24331 Specdb::CMs 147150 Specdb::MsMs 319900 Specdb::MsMs 319901 Specdb::MsMs 319902 Specdb::MsMs 367150 Specdb::MsMs 367151 Specdb::MsMs 367152 Specdb::MsMs 2757693 Specdb::MsMs 2757694 Specdb::MsMs 2757695 Specdb::MsMs 2948193 Specdb::MsMs 2948194 Specdb::MsMs 2948195 HMDB33478 #<Reference:0x000055ce3005ebb0> amber rose sweet ylang