1.0 2010-04-08 22:14:47 UTC 2015-07-21 06:42:22 UTC FDB020090 1,1-Dimethoxy-3,7-dimethyl-2,6-octadiene Flavouring ingredient 1,1-Dimethoxy-3,7-dimethyl-2,6-octadiene, 9CI Citral dimethyl acetal FEMA 2305 C12H22O2 198.3019 198.161979948 (6Z)-8,8-dimethoxy-2,6-dimethylocta-2,6-diene (6Z)-8,8-dimethoxy-2,6-dimethylocta-2,6-diene 7549-37-3 COC(OC)\C=C(\C)CCC=C(C)C InChI=1S/C12H22O2/c1-10(2)7-6-8-11(3)9-12(13-4)14-5/h7,9,12H,6,8H2,1-5H3/b11-9- ZSKAJFSSXURRGL-LUAWRHEFSA-N belongs to the class of organic compounds known as acyclic monoterpenoids. These are monoterpenes that do not contain a cycle. Acyclic monoterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Aliphatic acyclic compounds Acetals Hydrocarbon derivatives Acetal Acyclic monoterpenoid Aliphatic acyclic compound Hydrocarbon derivative Organic oxygen compound Organooxygen compound logp 3.13 ALOGPS logs -2.95 ALOGPS solubility 2.25e-01 g/l ALOGPS logp 3.42 ChemAxon pka_strongest_basic -4 ChemAxon iupac (6Z)-8,8-dimethoxy-2,6-dimethylocta-2,6-diene ChemAxon average_mass 198.3019 ChemAxon mono_mass 198.161979948 ChemAxon smiles COC(OC)\C=C(\C)CCC=C(C)C ChemAxon formula C12H22O2 ChemAxon inchi InChI=1S/C12H22O2/c1-10(2)7-6-8-11(3)9-12(13-4)14-5/h7,9,12H,6,8H2,1-5H3/b11-9- ChemAxon inchikey ZSKAJFSSXURRGL-LUAWRHEFSA-N ChemAxon polar_surface_area 18.46 ChemAxon refractivity 61.71 ChemAxon polarizability 24.25 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 18622 Specdb::CMs 29211 Specdb::CMs 102125 Specdb::CMs 137445 Specdb::CMs 145179 Specdb::MsIr 8936 Specdb::MsMs 307324 Specdb::MsMs 307325 Specdb::MsMs 307326 Specdb::MsMs 351247 Specdb::MsMs 351248 Specdb::MsMs 351249 Specdb::MsMs 2830450 Specdb::MsMs 2830451 Specdb::MsMs 2830452 Specdb::MsMs 2848268 Specdb::MsMs 2848269 Specdb::MsMs 2848270 HMDB40361 #<Reference:0x000055ce32260c68> citric floral green lemon lime natural