1.0 2010-04-08 22:11:35 UTC 2015-07-20 23:13:25 UTC FDB014994 Monomenthyl succinate Flavouring ingredient with a cooling, minty taste FEMA 3810 Mono[5-methyl-2-(1-methylethyl)cyclohexyl] butanedioate, 9CI C14H24O4 256.338 256.167459256 4-{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}-4-oxobutanoic acid 4-[(2-isopropyl-5-methylcyclohexyl)oxy]-4-oxobutanoic acid 188709-97-9 CC(C)C1CCC(C)CC1OC(=O)CCC(O)=O InChI=1S/C14H24O4/c1-9(2)11-5-4-10(3)8-12(11)18-14(17)7-6-13(15)16/h9-12H,4-8H2,1-3H3,(H,15,16) BLILOGGUTRWFNI-UHFFFAOYSA-N belongs to the class of organic compounds known as menthane monoterpenoids. These are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Menthane monoterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Aliphatic homomonocyclic compounds Carbonyl compounds Carboxylic acid esters Carboxylic acids Dicarboxylic acids and derivatives Fatty acid esters Hydrocarbon derivatives Monocyclic monoterpenoids Organic oxides Aliphatic homomonocyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Carboxylic acid ester Dicarboxylic acid or derivatives Fatty acid ester Fatty acyl Hydrocarbon derivative Monocyclic monoterpenoid Organic oxide Organic oxygen compound Organooxygen compound P-menthane monoterpenoid logp 2.97 ALOGPS logs -3.43 ALOGPS solubility 9.63e-02 g/l ALOGPS melting_point Mp 61.5-62.5° logp 2.93 ChemAxon pka_strongest_acidic 4.69 ChemAxon pka_strongest_basic -7 ChemAxon iupac 4-{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}-4-oxobutanoic acid ChemAxon average_mass 256.338 ChemAxon mono_mass 256.167459256 ChemAxon smiles CC(C)C1CCC(C)CC1OC(=O)CCC(O)=O ChemAxon formula C14H24O4 ChemAxon inchi InChI=1S/C14H24O4/c1-9(2)11-5-4-10(3)8-12(11)18-14(17)7-6-13(15)16/h9-12H,4-8H2,1-3H3,(H,15,16) ChemAxon inchikey BLILOGGUTRWFNI-UHFFFAOYSA-N ChemAxon polar_surface_area 63.6 ChemAxon refractivity 67.49 ChemAxon polarizability 28.74 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22296 Specdb::CMs 44748 Specdb::CMs 159401 Specdb::MsMs 107076 Specdb::MsMs 107077 Specdb::MsMs 107078 Specdb::MsMs 173961 Specdb::MsMs 173962 Specdb::MsMs 173963 Specdb::MsMs 2340510 Specdb::MsMs 2340511 Specdb::MsMs 2340512 Specdb::MsMs 2625497 Specdb::MsMs 2625498 Specdb::MsMs 2625499 HMDB36143 #<Reference:0x000055ce30ad14d0>