isoamyl (E)-cinnamate
isopentyl (E)-cinnamate

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Name: 3-methylbutyl (E)-3-phenylprop-2-enoate CAS Number: 85180-66-1 3D/inchi FDA UNII: AB60R20S7J Nikkaji Web: J183.086D XlogP3: 4.30 (est) Molecular Weight: 218.29586000 Formula: C14 H18 O2 BioActivity Summary: listing NMR Predictor: Predict (works with chrome, Edge or firefox) Category:flavor and fragrance agents   US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information: Google Scholar: Search Google Books: Search Google Scholar: with word "volatile" Search Google Scholar: with word "flavor" Search Google Scholar: with word "odor" Search Perfumer and Flavorist: Search Google Patents: Search US Patents: Search EU Patents: Search Pubchem Patents: Search PubMed: Search NCBI: Search   Physical Properties: Appearance: colorless to pale yellow clear liquid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.99200 to 0.99700 @ 25.00 °C. Pounds per Gallon - (est).: 8.254 to 8.296 Refractive Index: 1.53300 to 1.54100 @ 20.00 °C. Boiling Point: 310.00 to 311.00 °C. @ 760.00 mm Hg (est) Vapor Pressure: 0.001000 mmHg @ 25.00 °C. (est) Flash Point: > 200.00 °F. TCC ( > 93.33 °C. ) logP (o/w): 4.340 (est) Soluble in:   alcohol   water, 8.282 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Description:at 100.00 %. balsam Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers:   None found   Safety Information:   Hazards identification   Classification of the substance or mixture GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) None found. GHS Label elements, including precautionary statements   Pictogram   Hazard statement(s) None found. Precautionary statement(s) None found. Oral/Parenteral Toxicity: Not determined Dermal Toxicity: Not determined Inhalation Toxicity: Not determined   Safety in Use Information: Category: flavor and fragrance agents RIFM Fragrance Material Safety Assessment: Search IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice     Safety References: EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :5273467 National Institute of Allergy and Infectious Diseases:Data 3-methylbutyl (E)-3-phenylprop-2-enoate Chemidplus:0085180661 RTECS:UD3656100 for cas# 85180-66-1   References:   3-methylbutyl (E)-3-phenylprop-2-enoate NIST Chemistry WebBook: Search Inchi Pubchem (cid): 5273467 Pubchem (sid): 135019761   Other Information: (IUPAC): Atomic Weights of the Elements 2011 (pdf) Videos: The Periodic Table of Videos tgsc: Atomic Weights use for this web site (IUPAC): Periodic Table of the Elements CHEMBL: View HMDB (The Human Metabolome Database): Search VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these (E)-5- nonen-2-one FL/FR balsamic balsamic 2- acetyl furan FL/FR amyl cinnamate FL/FR amyl phenyl acetate FL/FR butyl cinnamate FL/FR caramellic fenugreek oleoresin FL/FR chocolate iso amyl phenyl acetate FL/FR chocolate pyrazine A FL/FR cocoa hexenal FL/FR cocoa oleoresin FL/FR cocoa pentenal FL/FR 2,6- dimethyl pyrazine FL/FR 2,5- dimethyl pyrazine FL/FR 2- methoxypyrazine FL/FR 2,4,5- trimethyl thiazole FL/FR cocoa 2-iso butyl-3,5-(and 3,6)-dimethyl pyrazine FL/FR 2- methyl butyraldehyde FL/FR ethereal iso propyl formate FL/FR propyl formate FL/FR fermented 3- methyl-1-pentanol FL/FR valeraldehyde FL/FR floral iso amyl salicylate FL/FR iso butyl salicylate FL/FR champaca absolute FR alpha- damascone FL/FR 2- ethyl hexyl salicylate FR ethyl phenyl acetate FL/FR iso eugenyl ethyl acetal FR geranyl phenyl acetate FL/FR beta- ionone FL/FR orris rhizome resinoid (iris pallida) FL/FR phenethyl salicylate FL/FR phenyl amyl alcohol FL/FR rose carboxylate FR tetrahydroionyl acetate FR tobacco flower absolute FR fruity 3- benzyl-4-heptanone FL/FR berry hexanoate FR butyl 2-methyl butyrate FL/FR iso butyl anthranilate FL/FR butyl anthranilate FL/FR butyl hexanoate FL/FR ethyl 2-hydroxy-3-methyl valerate FL/FR ethyl levulinate FL/FR ethyl methyl-para-tolyl glycidate FL/FR heliotropyl isobutyrate FL/FR beta- ionone epoxide FL/FR methyl 2-methyl valerate FL/FR methyl heptanoate FL/FR 3- nonen-2-one FL/FR osmanthus flower absolute FL/FR iso propenyl acetate FL/FR styralyl butyrate FL/FR vanilla carboxylate FL/FR green (Z)-3- hexen-1-yl 2-methyl butyrate FL/FR phenyl acetaldehyde FL/FR thiogeraniol FL/FR herbal hexyl salicylate FL/FR gamma- valerolactone FL/FR mentholic menthyl acetate racemic FL/FR musty cocoa butenal FL/FR nutty 3,6- cocoa pyrazine FL/FR 2,6- lutidine FL/FR 2- methyl pyrazine FL/FR 2,3,5,6- tetramethyl pyrazine FL/FR 2,3,5- trimethyl pyrazine FL/FR vinyl sulfurol FL/FR roasted fenugreek resinoid FL/FR soapy ambrettolide FL/FR spicy amyl isoeugenol FR benzyl isoeugenol FL/FR iso cyclogeraniol (IFF) FR dianthus ethone FR ethyl isoeugenol FL/FR iso eugenol FL/FR eugenyl acetate FL/FR iso eugenyl acetate FL/FR eugenyl phenyl acetate FL/FR methyl eugenol FR methyl isoeugenol FL/FR sulfurous blackberry thiophenone FL/FR buchu mercaptan FL/FR waxy (E)-2- octen-1-yl butyrate FL/FR phenethyl octanoate FL/FR woody dihydro-beta-ionol FL/FR patchouli ethanone FR For Flavor No flavor group found for these allyl tiglate FL amyl phenyl acetate FL/FR blackberry thiophenone FL/FR butyl cinnamate FL/FR 2-iso butyl-3,5-(and 3,6)-dimethyl pyrazine FL/FR 2(4)-iso butyl-4(2),6-dimethyl dihydro-4H-1,3,5-dithiazine FL chocolate pyrazine A FL/FR chocolate pyrazine B FL dihydro-beta-ionol FL/FR 4,5- dimethyl-2-ethyl thiazole FL ethyl 2-hydroxy-3-methyl valerate FL/FR eugenyl phenyl acetate FL/FR beta- ionone epoxide FL/FR menthyl acetate racemic FL/FR 2- methoxypyrazine FL/FR (E)-5- nonen-2-one FL/FR (E)-2- octen-1-yl butyrate FL/FR (E)-2- octen-4-ol FL peanut dithiazine FL phenyl amyl alcohol FL/FR balsamic balsamic amyl cinnamate FL/FR bitter methyl ethoxypyrazine FL brown fenugreek oleoresin FL/FR caramellic fenugreek resinoid FL/FR chocolate cocoa oleoresin FL/FR cocoa propanal FL cocoa butyraldehyde FL cocoa hexenal FL/FR cooling iso butyl salicylate FL/FR ethereal iso propenyl acetate FL/FR floral iso amyl phenyl acetate FL/FR cocoa pentenal FL/FR geranyl phenyl acetate FL/FR orris rhizome resinoid (iris pallida) FL/FR fruity 3- benzyl-4-heptanone FL/FR butyl 2-methyl butyrate FL/FR butyl anthranilate FL/FR iso butyl anthranilate FL/FR butyl hexanoate FL/FR alpha- damascone FL/FR ethyl 3-oxohexanoate FL ethyl levulinate FL/FR ethyl methyl-para-tolyl glycidate FL/FR heliotropyl isobutyrate FL/FR methyl 2-methyl valerate FL/FR methyl heptanoate FL/FR osmanthus flower absolute FL/FR phenethyl octanoate FL/FR propyl formate FL/FR iso propyl formate FL/FR styralyl butyrate FL/FR vanilla carboxylate FL/FR fusel 2- methyl butyraldehyde FL/FR green iso amyl salicylate FL/FR cocoa butenal FL/FR 2- ethyl butyraldehyde FL (Z)-3- hexen-1-yl 2-methyl butyrate FL/FR thiogeraniol FL/FR herbal hexyl salicylate FL/FR honey ethyl phenyl acetate FL/FR phenyl acetaldehyde FL/FR meaty 2,6- dimethyl pyrazine FL/FR medicinal, phenethyl salicylate FL/FR musty 2,5- dimethyl pyrazine FL/FR propionaldehyde FL 2,3,5- trimethyl pyrazine FL/FR nutty 2- acetyl furan FL/FR 3,6- cocoa pyrazine FL/FR 2,4- dimethyl-5-vinyl thiazole FL 2,6- lutidine FL/FR 2- methyl pyrazine FL/FR 2,3,5,6- tetramethyl pyrazine FL/FR 2,4,5- trimethyl thiazole FL/FR vinyl sulfurol FL/FR oily 3- nonen-2-one FL/FR soapy ambrettolide FL/FR spicy benzyl isoeugenol FL/FR ethyl isoeugenol FL/FR iso eugenol FL/FR eugenyl acetate FL/FR iso eugenyl acetate FL/FR methyl isoeugenol FL/FR sulfurous buchu mercaptan FL/FR tonka gamma- valerolactone FL/FR whiskey 3- methyl-1-pentanol FL/FR winey valeraldehyde FL/FR woody beta- ionone FL/FR   Potential Uses: FR amber FR apricot FR balsam FR berry FR carnation FL chocolate cocoa FR floral FR honey FR orchid FR oriental FR peach FR spice   Occurrence (nature, food, other):note   cinnamon Search PMC Picture   Synonyms: iso amyl (E)-3-phenyl propenoate iso amyl (E)-beta-phenyl acrylate iso amyl trans-3-phenyl propenoate iso amyl trans-beta-phenyl acrylate iso amyl trans-cinnamate (E)- cinnamic acid isoamyl ester trans- cinnamic acid isoamyl ester (E)- cinnamic acid isopentyl ester trans- cinnamic acid isopentyl ester 3- methyl butyl (E)-3-phenyl-2-propenoate 3- methyl butyl trans-3-phenyl-2-propenoate 3- methylbutyl (E)-3-phenylprop-2-enoate 3- methylbutyl trans-3-phenylprop-2-enoate iso pentyl (E)-3-phenyl acrylate iso pentyl (E)-3-phenyl propenoate iso pentyl (E)-beta-phenyl acrylate iso pentyl (E)-cinnamate iso pentyl (trans-3-phenyl acrylate iso pentyl alcohol (E)-cinnamate iso pentyl alcoholtrans-cinnamate iso pentyl trans-3-phenyl propenoate iso pentyl trans-beta-phenyl acrylate iso pentyl trans-cinnamate   Articles:   None found yet. 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Notes: None found

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