(Z)-3-hexen-1-yl 2-methyl-2-pentenoate
cis-3-hexenyl 2-methyl-2-pentenoate

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  CODE101778 CODE101778
  Product(s):
  76649-17-7 cis-3-HEXENYL 2-METHYL-2-PENTENOATE 98.0% (sum of isomers

Name: [(E)-hex-3-enyl] (Z)-2-methylpent-2-enoate CAS Number: 76649-17-7 3D/inchi % from: 96.00% to 99.90% ECHA EINECS - REACH Pre-Reg: 278-511-5 FDA UNII: Search XlogP3-AA: 3.50 (est) Molecular Weight: 196.28980000 Formula: C12 H20 O2 NMR Predictor: Predict (works with chrome, Edge or firefox) Category: 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 clear liquid (est) Assay: 98.00 to 100.00 sum of isomers Food Chemicals Codex Listed: No Specific Gravity: 0.90100 to 0.91200 @ 25.00 °C. Pounds per Gallon - (est).: 7.497 to 7.589 Refractive Index: 1.45500 to 1.46500 @ 20.00 °C. Boiling Point: 125.00 °C. @ 25.00 mm Hg Vapor Pressure: 0.010000 mmHg @ 25.00 °C. (est) Vapor Density: >1 ( Air = 1 ) Flash Point: 220.00 °F. TCC ( 104.44 °C. ) logP (o/w): 4.222 (est) Soluble in:   alcohol   water, 7.69 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: fruity Odor Strength:high , recommend smelling in a 10.00 % solution or less Substantivity:12 hour(s) at 100.00 % fresh green natural metallic tropical waxy Odor Description:at 10.00 % in dipropylene glycol. fresh green natural metallic tropical waxy Luebke, William tgsc, (1989) Odor sample from: Bedoukian Research, Inc. Flavor Type: green fresh green fruity tropical spicy oily waxy mango mahogany Taste Description: fresh green fruity tropical spicy oily waxy mango mahogany Luebke, William tgsc, (1989) Odor and/or flavor descriptions from others (if found). Bedoukian Research cis-3-HEXENYL 2-METHYL-2-PENTENOATE 96.0% - 99.9% (cis), Kosher Odor Description:A powerful fruity-green odor with natural connotations Used in specialty fragrances.   Cosmetic Information: None found   Suppliers: BOC Sciences For experimental / research use only. cis-3-HEXENYL 2-METHYL-2-PENTENOATE 98.0% (sum of isomers   Safety Information: Preferred SDS: View European information : Most important hazard(s): None - None found. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes.   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: fragrance agents RIFM Fragrance Material Safety Assessment: Search IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice Recommendation for (Z)-3-hexen-1-yl 2-methyl-2-pentenoate usage levels up to:   2.0000 % in the fragrance concentrate.   Recommendation for (Z)-3-hexen-1-yl 2-methyl-2-pentenoate flavor usage levels up to:   not for flavor use.   Safety References: EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):76649-17-7 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :6441873 National Institute of Allergy and Infectious Diseases:Data WGK Germany:2 [(E)-hex-3-enyl] (Z)-2-methylpent-2-enoate Chemidplus:0076649177   References:   [(E)-hex-3-enyl] (Z)-2-methylpent-2-enoate NIST Chemistry WebBook: Search Inchi Pubchem (cid): 6441873 Pubchem (sid): 135192665   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 HMDB (The Human Metabolome Database): Search Export Tariff Code: 2916.19.6000 ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these (E)- tiglaldehyde FL/FR aldehydic aldehydic lily pentanal FR 2- methyl undecanal dimethyl acetal FR balsamic iso amyl benzoate FL/FR cheesy S-( methyl thio) butyrate FL/FR citrus 2- heptanol FL/FR creamy 3- heptyl dihydro-5-methyl-2(3H)-furanone FL/FR dairy methyl butyl phenyl acetate FL/FR ethereal 2- methyl valeraldehyde FL/FR fatty 3- decen-2-one FL/FR hexyl pivalate FR methyl (E)-2-hexenoate FL/FR methyl 2-hexenoate FL/FR fermented 3- methyl-1-pentanol FL/FR floral alpha- amyl cinnamaldehyde diethyl acetal FR citronellyl propionate FL/FR gamma- damascone FR 6,8- dimethyl-2-nonanol FR geranyl acetate FL/FR (E)- geranyl acetone FL/FR geranyl hexanoate FL/FR alpha- hexyl cinnamaldehyde FL/FR hydroxycitronellal FL/FR jasmin absolute egypt (from concrete) FL/FR jasmin cyclopentanol FR lily propanol FR papaya isobutyrate FL/FR rose butanoate FL/FR fruity acetaldehyde dihexyl acetal FL/FR allyl amyl glycolate FR allyl butyrate FL/FR allyl cyclohexyl acetate FL/FR allyl heptanoate FL/FR iso amyl butyrate FL/FR amyl hexanoate FL/FR iso amyl isobutyrate FL/FR iso amyl isovalerate FL/FR iso amyl octanoate FL/FR berry pentadienoate FL/FR butyl 2-methyl butyrate FL/FR butyl isobutyrate FL/FR iso butyl propionate FL/FR cherry pentenoate FL/FR cinnamyl isobutyrate FL/FR cyclohexyl propionate FL/FR 2- cyclopentyl cyclopentanone FL/FR decyl butyrate FL/FR diethyl malonate FL/FR dimethyl succinate FL/FR ethyl 2-cyclohexyl propionate FR ethyl 2-octenoate FL/FR ethyl 3-acetoxyhexanoate FL/FR ethyl 3-hexenoate FL/FR ethyl 3,5,5-trimethyl hexanoate FR ethyl acetoacetate FL/FR ethyl methyl-para-tolyl glycidate FL/FR geranyl isovalerate FL/FR grape butyrate FL/FR heptanal cyclic ethylene acetal FR (E)-2- hepten-1-yl acetate FL/FR heptyl isobutyrate FL/FR hexanal propylene glycol acetal FL/FR 3- hexanone FL/FR 2- hexen-1-ol FL/FR (E)-3- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl isobutyrate FL/FR hexyl (E)-tiglate FL/FR hexyl acetate FL/FR hexyl isovalerate FL/FR hexyl propionate FL/FR linalyl hexanoate FL/FR methyl (E,Z)-2,4-decadienoate FL/FR methyl 3-nonenoate FL/FR 2- methyl butyl 2-methyl butyrate FL/FR methyl heptanoate FL/FR methyl nonanoate FL/FR methyl valerate FL/FR nerolidyl isobutyrate FR (E)-2- nonen-1-yl acetate FL/FR octen-1-yl cyclopentanone FL/FR octyl butyrate FL/FR 2- pentyl furan FL/FR 4- phenyl-2-butyl acetate FL/FR pineapple pentenoate FL/FR prenol FL/FR prenyl ethyl ether FL/FR prenyl hexanoate FL/FR iso propyl 2-methyl butyrate FL/FR rhubarb undecane FR tetrahydrofurfuryl butyrate FL/FR tropical indene FR tropical thiazole FL/FR green acetaldehyde benzyl 2-methoxyethyl acetal FL/FR acetaldehyde methyl hexyl acetal FR iso amyl formate FL/FR cognac heptanone FL/FR 2- cyclohexyl propionaldehyde FR alpha- decalactone FL/FR ethyl (E,Z)-2,4-decadienoate FL/FR ethyl (E)-2-decenoate FL/FR ethyl (E)-2-hexenoate FL/FR ethyl (E)-4-decenoate FL/FR green dioxolane FR heptyl formate FL/FR (Z)-3- hexen-1-yl (E)-2-hexenoate FL/FR (Z)-3- hexen-1-yl acetate FL/FR (E)-2- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl formate FL/FR (E)-2- hexen-1-yl formate FL/FR (E)-2- hexen-1-yl hexanoate FL/FR (Z)-3- hexen-1-yl hexanoate FL/FR (Z)-3- hexen-1-yl isovalerate FL/FR (E)-2- hexen-1-yl isovalerate FL/FR (Z)-3- hexen-1-yl propionate FL/FR (E)-2- hexen-1-yl propionate FL/FR (E)-2- hexen-1-yl valerate FL/FR (Z)-3- hexen-1-yl valerate FL/FR 2- hexenyl acetate FL/FR hexyl 2-methyl butyrate FL/FR hexyl butyrate FL/FR hexyl isobutyrate FL/FR hexyl octanoate FL/FR hexyl phenyl acetate FL/FR hexyl tiglate FL/FR manzanate (Givaudan) FL/FR melon nonenoate FL/FR neryl butyrate FL/FR (E)-2- pentenal FL/FR phenoxyethyl isobutyrate FL/FR phenyl acetaldehyde ethylene glycol acetal FR alpha-iso propyl phenyl acetaldehyde FL/FR propylene acetal FL/FR sorbyl isobutyrate FL/FR thiogeraniol FL/FR violet dienyne FR herbal clary sage resin america FR sulfurous buchu mercaptan FL/FR tropical beta- cyclocitral FL/FR hexyl 2-methyl-3-pentenoate FL/FR vegetable 1- furfuryl pyrrole FL/FR waxy 9- decenoic acid FL/FR (E)- methyl geranate FL/FR octyl 2-methyl butyrate FL/FR woody verdoxan FR woody acetate FR For Flavor No flavor group found for these acetaldehyde benzyl 2-methoxyethyl acetal FL/FR allyl tiglate FL 2- cyclopentyl cyclopentanone FL/FR alpha- decalactone FL/FR ethyl 3-acetoxyhexanoate FL/FR (E,E)-2,4- heptadien-1-ol FL (E)-2- hepten-1-yl acetate FL/FR 2- hexenal FL 2- hexenal diethyl acetal FL 2- hexenyl acetate FL/FR hexyl (E)-2-hexenoate FL hexyl propionate FL/FR linalyl hexanoate FL/FR methyl (E,Z)-2,4-decadienoate FL/FR methyl (E)-2-hexenoate FL/FR methyl 2-hexenoate FL/FR methyl 4-pentenoate FL (E)- methyl geranate FL/FR 2- methyl-2-octenal FL (E)-2- methyl-2-octenal FL 3- methyl-3-pentanol FL (E,E)-3,5- octadien-2-one FL 4- phenyl-2-butyl acetate FL/FR prenyl ethyl ether FL/FR prenyl hexanoate FL/FR alpha-iso propyl phenyl acetaldehyde FL/FR propylene acetal FL/FR (E)- tiglaldehyde FL/FR sorbyl isobutyrate FL/FR alliaceous alliaceous tropical thiazole FL/FR berry heptyl isobutyrate FL/FR citrus cognac heptanone FL/FR cooling manzanate (Givaudan) FL/FR dairy methyl butyl phenyl acetate FL/FR earthy 1- hexen-3-yl acetate FL estery ethyl acetoacetate FL/FR fatty ethyl (E)-4-decenoate FL/FR heptyl formate FL/FR floral citronellyl propionate FL/FR (E)- geranyl acetone FL/FR jasmin absolute egypt (from concrete) FL/FR fruity allyl cyclohexyl acetate FL/FR allyl heptanoate FL/FR iso amyl benzoate FL/FR amyl hexanoate FL/FR iso amyl isobutyrate FL/FR iso amyl octanoate FL/FR berry pentadienoate FL/FR butyl 2-methyl butyrate FL/FR butyl isobutyrate FL/FR iso butyl propionate FL/FR cherry pentenoate FL/FR cinnamyl isobutyrate FL/FR cyclohexyl propionate FL/FR decyl butyrate FL/FR diethyl malonate FL/FR dimethyl succinate FL/FR ethyl (E)-2-decenoate FL/FR ethyl (E)-2-hexenoate FL/FR ethyl (E)-2-octenoate FL ethyl 2-octenoate FL/FR ethyl 3-hexenoate FL/FR ethyl methyl-para-tolyl glycidate FL/FR furfuryl propionate FL geranyl hexanoate FL/FR 2- heptanol FL/FR 3- heptyl dihydro-5-methyl-2(3H)-furanone FL/FR hexanal propylene glycol acetal FL/FR 3- hexanone FL/FR 2- hexen-1-ol FL/FR (Z)-3- hexen-1-yl (E)-2-hexenoate FL/FR (E)-3- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl isobutyrate FL/FR hexyl 2-methyl-3-pentenoate FL/FR hexyl acetate FL/FR hexyl phenyl acetate FL/FR methyl (E)-3-nonenoate FL methyl 3-nonenoate FL/FR 2- methyl butyl 2-methyl butyrate FL/FR methyl heptanoate FL/FR methyl valerate FL/FR octen-1-yl cyclopentanone FL/FR pineapple pentenoate FL/FR prenol FL/FR iso propyl 2-methyl butyrate FL/FR rose butanoate FL/FR tetrahydrofurfuryl butyrate FL/FR green acetaldehyde dihexyl acetal FL/FR allyl butyrate FL/FR iso amyl formate FL/FR iso amyl isovalerate FL/FR 3- decen-2-one FL/FR ethyl (E,Z)-2,4-decadienoate FL/FR geranyl acetate FL/FR geranyl isovalerate FL/FR grape butyrate FL/FR (E)-2- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl formate FL/FR (E)-2- hexen-1-yl hexanoate FL/FR (Z)-3- hexen-1-yl hexanoate FL/FR (E)-2- hexen-1-yl isovalerate FL/FR (Z)-3- hexen-1-yl isovalerate FL/FR (Z)-3- hexen-1-yl propionate FL/FR (E)-2- hexen-1-yl propionate FL/FR (Z)-3- hexen-1-yl valerate FL/FR (E)-2- hexen-1-yl valerate FL/FR (E)-2- hexenal diethyl acetal FL hexyl (E)-tiglate FL/FR hexyl 2-methyl butyrate FL/FR hexyl butyrate FL/FR hexyl isobutyrate FL/FR hexyl isovalerate FL/FR hexyl octanoate FL/FR hexyl tiglate FL/FR melon nonenoate FL/FR methyl 2-undecynoate FL neryl butyrate FL/FR papaya isobutyrate FL/FR (E)-2- pentenal FL/FR 2- pentyl furan FL/FR phenoxyethyl isobutyrate FL/FR thiogeraniol FL/FR musty S-( methyl thio) butyrate FL/FR rummy (E)-2- hexen-1-yl formate FL/FR sour 3- methyl valeric acid FL sulfurous buchu mercaptan FL/FR tropical beta- cyclocitral FL/FR vegetable 1- furfuryl pyrrole FL/FR 2- methyl valeraldehyde FL/FR waxy iso amyl butyrate FL/FR 9- decenoic acid FL/FR alpha- hexyl cinnamaldehyde FL/FR hydroxycitronellal FL/FR (E)-2- nonen-1-yl acetate FL/FR octyl 2-methyl butyrate FL/FR octyl butyrate FL/FR whiskey 3- methyl-1-pentanol FL/FR winey methyl nonanoate FL/FR   Potential Uses: FR apple FR fruit FR green FR hyacinth FR jasmin FR reseda   waxy   Occurrence (nature, food, other):note   not found in nature   Synonyms:   green pentenoate [(E)- hex-3-enyl] (Z)-2-methylpent-2-enoate cis-3- hexen-1-yl 2-methyl-2-pentenoate (Z)-3- hexen-1yl 2-methyl pent-2-en-1-oate cis-3- hexen-1yl 2-methylpent-2-en-1-oate (Z)-3- hexenyl 2-methyl-2-pentenoate cis-3- hexenyl 2-methyl-2-pentenoate 2- methyl-2-pentenoic acid (3Z)-3-hexenyl ester 2- pentenoic acid, 2-methyl-, (3Z)-3-hexenyl ester   Articles:   None found yet. 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Notes: None found