1.0 2010-04-08 22:13:05 UTC 2019-11-26 03:14:50 UTC FDB017433 Geijerone Constituent of Juniperus communis (juniper). Geijerone is found in fruits. 3-Isopropenyl-4-methyl-4-vinylcyclohexanone 4-Ethenyl-4-methyl-3-(1-methylethenyl)cyclohexanone, 9CI Geijeron C12H18O 178.2707 178.135765198 4-ethenyl-4-methyl-3-(prop-1-en-2-yl)cyclohexan-1-one 4-ethenyl-4-methyl-3-(prop-1-en-2-yl)cyclohexan-1-one 41411-01-2 CC(=C)C1CC(=O)CCC1(C)C=C InChI=1S/C12H18O/c1-5-12(4)7-6-10(13)8-11(12)9(2)3/h5,11H,1-2,6-8H2,3-4H3 TYUCDLXRFGFSBR-UHFFFAOYSA-N belongs to the class of organic compounds known as monocyclic monoterpenoids. These are monoterpenoids containing 1 ring in the isoprene chain. Monocyclic monoterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Aliphatic homomonocyclic compounds Cyclic ketones Hydrocarbon derivatives Organic oxides Aliphatic homomonocyclic compound Carbonyl group Cyclic ketone Hydrocarbon derivative Ketone Monocyclic monoterpenoid Organic oxide Organic oxygen compound Organooxygen compound logp 3.26 ALOGPS logs -3.43 ALOGPS solubility 6.69e-02 g/l ALOGPS logp 2.89 ChemAxon pka_strongest_acidic 19.91 ChemAxon pka_strongest_basic -7.4 ChemAxon iupac 4-ethenyl-4-methyl-3-(prop-1-en-2-yl)cyclohexan-1-one ChemAxon average_mass 178.2707 ChemAxon mono_mass 178.135765198 ChemAxon smiles CC(=C)C1CC(=O)CCC1(C)C=C ChemAxon formula C12H18O ChemAxon inchi InChI=1S/C12H18O/c1-5-12(4)7-6-10(13)8-11(12)9(2)3/h5,11H,1-2,6-8H2,3-4H3 ChemAxon inchikey TYUCDLXRFGFSBR-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 55.39 ChemAxon polarizability 20.97 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 16124 Specdb::CMs 131724 Specdb::CMs 139458 Specdb::MsMs 84342 Specdb::MsMs 84343 Specdb::MsMs 84344 Specdb::MsMs 146172 Specdb::MsMs 146173 Specdb::MsMs 146174 Specdb::MsMs 3057407 Specdb::MsMs 3057408 Specdb::MsMs 3057409 Specdb::MsMs 3113822 Specdb::MsMs 3113823 Specdb::MsMs 3113824 HMDB38194 #<Reference:0x000055ce334f2ea8> Fruits Unknown generic