1.02010-04-08 22:05:47 UTC2019-11-26 02:59:11 UTCFDB003417Cyclohexyl acetateCyclohexyl acetate is a flavouring agent. It is found in many foods, some of which are pulses, soy bean, brassicas, and onion-family vegetables.Acetic acid cyclohexyl esterAcetic acid, cyclohexyl esterAdronal acetateCyclohexane acetateCyclohexanol, acetateCyclohexanolazetatCyclohexanyl acetateCyclohexyl ester of acetic acidCyclohexylester kyseliny octoveFEMA 2349H.a. solventHexalin acetateC8H14O2142.1956142.099379692cyclohexyl acetatecyclohexyl acetate622-45-7CC(=O)OC1CCCCC1InChI=1S/C8H14O2/c1-7(9)10-8-5-3-2-4-6-8/h8H,2-6H2,1H3YYLLIJHXUHJATK-UHFFFAOYSA-N belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group).Carboxylic acid estersOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesCarboxylic acid derivativesAliphatic homomonocyclic compoundsCarbonyl compoundsHydrocarbon derivativesMonocarboxylic acids and derivativesOrganic oxidesAliphatic homomonocyclic compoundCarbonyl groupCarboxylic acid esterHydrocarbon derivativeMonocarboxylic acid or derivativesOrganic oxideOrganic oxygen compoundOrganooxygen compoundcarboxylic esterLiquidlogp2.05logs-2.13solubility1.06e+00 g/lmelting_point-65 oClogp1.72pka_strongest_basic-7iupaccyclohexyl acetateaverage_mass142.1956mono_mass142.099379692smilesCC(=O)OC1CCCCC1formulaC8H14O2inchiInChI=1S/C8H14O2/c1-7(9)10-8-5-3-2-4-6-8/h8H,2-6H2,1H3inchikeyYYLLIJHXUHJATK-UHFFFAOYSA-Npolar_surface_area26.3refractivity38.43polarizability16.03rotatable_bond_count2acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::EiMs1966Specdb::NmrOneD3934Specdb::NmrOneD4213Specdb::MsIr4407Specdb::MsIr4408Specdb::CMs24535Specdb::CMs27054Specdb::CMs27197Specdb::CMs28085Specdb::CMs28127Specdb::CMs28504Specdb::CMs100751Specdb::CMs100752Specdb::CMs100753Specdb::CMs100754Specdb::CMs100755Specdb::CMs166559Specdb::MsMs320266Specdb::MsMs320267Specdb::MsMs320268Specdb::MsMs367606Specdb::MsMs367607Specdb::MsMs367608Specdb::MsMs2780023Specdb::MsMs2780024Specdb::MsMs2780025Specdb::MsMs2925364Specdb::MsMs2925365Specdb::MsMs2925366HMDB31352#<Reference:0x0000555675b4f728>BrassicasUnknowngeneric3705Garden onionType 1specificAllium cepa4679Garden onion (var.)Type 1specificAllium cepa var. cepa4679Green onionType 1Onion-family vegetablesUnknowngenericPulsesUnknowngenericRed onionType 1Soy beanType 1specificGlycine max3847Welsh onionType 1specificAllium fistulosum35875etherealfruitymustysweet