1.02010-04-08 22:04:44 UTC2019-11-26 02:55:34 UTCFDB0008724-MethoxybenzaldehydeFound in anise oil, fennel and vanilla. Flavouring ingredient
Anisaldehyde, or anisic aldehyde, is an organic compound that consists of a benzene ring substituted with an aldehyde and a methoxy group. It is a clear colorless liquid with a strong aroma. It comes in 3 varieties, ortho, meta, and para in which the two functional groups (methoxy and aldehyde) are alpha, beta, and gamma, respectively to each other. The unmodified term anisaldehyde generally refers to the para isomer. Anisaldehyde is found in anise, from which it gets its name. It is similar in structure to vanillin.4-AnisaldehydeAnisalAnisaldehydeAnisic aldehydeAubepineBenzaldehyde, 4-methoxy-CrategineFEMA 2670Formylanisole, p-Obepinp-Anisaldehyde, 8CIp-Anisic aldehydep-Formylanisolep-Methoxybenzaldehydepara-AnisaldehydeC8H8O2136.1479136.05242954-methoxybenzaldehydeanisaldehyde123-11-5COC1=CC=C(C=O)C=C1InChI=1S/C8H8O2/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3ZRSNZINYAWTAHE-UHFFFAOYSA-N belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).Benzoyl derivativesOrganic compoundsBenzenoidsBenzene and substituted derivativesBenzoyl derivativesAromatic homomonocyclic compoundsAlkyl aryl ethersAnisolesBenzaldehydesHydrocarbon derivativesMethoxybenzenesOrganic oxidesPhenoxy compoundsAldehydeAlkyl aryl etherAnisoleAromatic homomonocyclic compoundAryl-aldehydeBenzaldehydeBenzoylEtherHydrocarbon derivativeMethoxybenzeneOrganic oxideOrganic oxygen compoundOrganooxygen compoundPhenol etherPhenoxy compoundaldehydeLiquidlogp1.64logs-1.90solubility1.71e+00 g/lmelting_pointMp 0°logp1.53pka_strongest_basic-4.8iupac4-methoxybenzaldehydeaverage_mass136.1479mono_mass136.0524295smilesCOC1=CC=C(C=O)C=C1formulaC8H8O2inchiInChI=1S/C8H8O2/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3inchikeyZRSNZINYAWTAHE-UHFFFAOYSA-Npolar_surface_area26.3refractivity39.11polarizability14rotatable_bond_count2acceptor_count2donor_count0physiological_charge0formal_charge0Specdb::EiMs1859Specdb::MsIr3591Specdb::MsIr3592Specdb::CMs5755Specdb::CMs26861Specdb::CMs27150Specdb::CMs27697Specdb::CMs29245Specdb::CMs29296Specdb::CMs100406Specdb::CMs100407Specdb::CMs100408Specdb::CMs100409Specdb::CMs100410Specdb::CMs169178Specdb::NmrOneD3820Specdb::NmrOneD4085Specdb::NmrOneD110018Specdb::NmrOneD110019Specdb::NmrOneD110020Specdb::NmrOneD110021Specdb::NmrOneD110022Specdb::NmrOneD110023Specdb::NmrOneD110024Specdb::NmrOneD110025Specdb::NmrOneD110026Specdb::NmrOneD110027Specdb::NmrOneD110028Specdb::NmrOneD110029Specdb::NmrOneD110030Specdb::NmrOneD110031Specdb::NmrOneD110032Specdb::NmrOneD110033Specdb::NmrOneD110034Specdb::NmrOneD110035Specdb::NmrOneD110036Specdb::NmrOneD110037Specdb::MsMs64857Specdb::MsMs64858Specdb::MsMs64859Specdb::MsMs122133Specdb::MsMs122134Specdb::MsMs122135Specdb::MsMs2256726Specdb::MsMs2258764Specdb::MsMs2259820Specdb::MsMs2745299Specdb::MsMs2745300Specdb::MsMs2745301Specdb::MsMs2936251Specdb::MsMs2936252Specdb::MsMs2936253HMDB29686#<Reference:0x0000555675e7ba50>American cranberryType 1specificVaccinium macrocarpon13750AniseType 1specificPimpinella anisum271192Black teaType 1CornmintType 1specificMentha arvensis292239CuminType 1specificCuminum cyminum5246283.783.783.7mg/100 gDillType 1specificAnethum graveolens40922FennelType 1specificFoeniculum vulgare4803827.28928654.050.528571439mg/100 gGreen teaType 1Herbal teaType 1Herbs and SpicesUnknowngenericPine nutType 1specificPinus3337Red teaType 1RoselleType 1specificHibiscus sabdariffa183260Star aniseType 1specificIllicium verum12477852.052.052.0mg/100 gSweet basilType 1specificOcimum basilicum39350TarragonType 1specificArtemisia dracunculus72341TeaType 1specificCamellia sinensis4442VanillaType 1specificVanilla51238almondanisebalsamberrybittercherrychocolatecinnamoncreamyfloralhawthornhawthornemimosamintmintypowderysweetvanillaanti mutagenic451cosmetic838The role played by a substance in enhancing the appearance or odour of the human body; a name given to the substance itself or to a component of it.flavor936A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.fungicide940A substance used to destroy fungal pests.insecticide1040Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.irritant1055nematicide1141A substance used to destroy pests of the phylum Nematoda (roundworms).perfumery1206A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.pesticide1210Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.piscicide1228sedative1311A central nervous system depressant used to induce drowsiness or sleep or to reduce psychological excitement or anxiety.tyrosinase inhibitor1389Any EC 1.14.18.* (oxidoreductase acting on paired donors, miscellaneous compound as one donor, incorporating 1 atom of oxygen) inhibitor that interferes with the action of tyrosinase (monophenol monooxygenase), EC 1.14.18.1, an enzyme that catalyses the oxidation of phenols (such as tyrosine) and is widespread in plants and animals.