1.02010-04-08 22:12:16 UTC2019-11-26 03:12:50 UTCFDB0161562-Isopropyl-5-methyl-2-hexenal2-Isopropyl-5-methyl-2-hexenal is a flavouring ingredient. It is found in cocoa and preserved feijowa sellowiana fruits. It is a minor aroma constituent of malted barley. It is also found in cereals and cereal products.(2E)-2-Isopropyl-5-methyl-2-hexenal2-Hexen-1-al, 2-isopropyl-5-methyl-2-Hexen-1-al, 5-methyl-2-(1-methylethyl)-2-Hexenal, 2-isopropyl-5-methyl-2-Hexenal, 5-methyl-2-(1-methylethyl)-2-Isopropyl-3-isobutylacrolein2-Isopropyl-5-methyl-2-hexen-1-al2-Isopropyl-5-methylhex-2-enal2,6-Dimethyl-3-formyl-3-heptene5-Methyl-2-(1-methylethyl)-2-hexen-1-al5-Methyl-2-(1-methylethyl)-2-hexenal5-Methyl-2-(1-methylethyl)-2-hexenal, 9CIAlpha-isopropyl-beta-isobutylacroleincis-5-Methyl-2-isopropyl-2-hexen-1-alFEMA 3406Isodihydroavandulyl aldehydeIsodihydrolavandulyl aldehydeIsodihydrovandulyl aldehydetrans-5-Methyl-2-isopropyl-2-hexen-1-alC10H18O154.2493154.135765198(2Z)-5-methyl-2-(propan-2-yl)hex-2-enal(2Z)-2-isopropyl-5-methylhex-2-enal35158-25-9CC(C)C\C=C(/C=O)C(C)CInChI=1S/C10H18O/c1-8(2)5-6-10(7-11)9(3)4/h6-9H,5H2,1-4H3/b10-6+IOLQAHFPDADCHJ-UXBLZVDNSA-N belongs to the class of organic compounds known as medium-chain aldehydes. These are an aldehyde with a chain length containing between 6 and 12 carbon atoms.Medium-chain aldehydesOrganic compoundsOrganic oxygen compoundsOrganooxygen compoundsCarbonyl compoundsAliphatic acyclic compoundsEnalsHydrocarbon derivativesOrganic oxidesAliphatic acyclic compoundAlpha,beta-unsaturated aldehydeEnalHydrocarbon derivativeMedium-chain aldehydeOrganic oxidelogp3.39logs-2.58solubility4.03e-01 g/llogp3.06pka_strongest_basic-4.4iupac(2Z)-5-methyl-2-(propan-2-yl)hex-2-enalaverage_mass154.2493mono_mass154.135765198smilesCC(C)C\C=C(/C=O)C(C)CformulaC10H18OinchiInChI=1S/C10H18O/c1-8(2)5-6-10(7-11)9(3)4/h6-9H,5H2,1-4H3/b10-6+inchikeyIOLQAHFPDADCHJ-UXBLZVDNSA-Npolar_surface_area17.07refractivity49.3polarizability18.89rotatable_bond_count4acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::CMs16504Specdb::CMs134195Specdb::CMs141929Specdb::MsIr7425Specdb::MsIr7426Specdb::MsMs302479Specdb::MsMs302480Specdb::MsMs302481Specdb::MsMs345223Specdb::MsMs345224Specdb::MsMs345225Specdb::MsMs2302632Specdb::MsMs2302633Specdb::MsMs2302634Specdb::MsMs3066455Specdb::MsMs3066456Specdb::MsMs3066457HMDB37161#<Reference:0x00005556740b11a0>Breakfast cerealType 2specificCereals and cereal productsUnknowngenericCocoa and cocoa productsUnknowngenericCocoa beanType 1specificTheobroma cacao3641FruitsUnknowngenericblueberrygreenherballavendertomatowoody