ethyl (Z)-3-hexenoate
ethyl cis-3-hexenoate

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  BOC Sciences

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  CODE143325 CODE143325
  Product(s):
  64187-83-3 Ethyl (Z)hex-3-enoate

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  Penta International Corporation

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  Product(s):
  05-38300 ETHYL CIS-3-HEXENOATE
  05-38310 ETHYL CIS-3-HEXENOATE NATURAL

Name: ethyl (Z)-hex-3-enoate CAS Number: 64187-83-3 3D/inchi ECHA EINECS - REACH Pre-Reg: 264-724-0 FDA UNII: R35DY1229O Nikkaji Web: J126.494J XlogP3-AA: 1.90 (est) Molecular Weight: 142.19798000 Formula: C8 H14 O2 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 JECFA Food Flavoring: 1626 ethyl (Z)-3-hexenoate DG SANTE Food Flavourings: 09.939 ethyl (3Z)-hexenoate FEMA Number: 4112 ethyl cis-3-hexenoate FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 64187-83-3 ; ETHYL CIS-3-HEXENOATE   Physical Properties: Appearance: colorless to pale yellow clear liquid (est) Assay: 96.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.89300 to 0.90300 @ 25.00 °C. Pounds per Gallon - (est).: 7.431 to 7.514 Refractive Index: 1.42000 to 1.42900 @ 20.00 °C. Boiling Point: 90.00 °C. @ 50.00 mm Hg Boiling Point: 169.00 to 170.00 °C. @ 760.00 mm Hg Vapor Pressure: 1.553000 mmHg @ 25.00 °C. (est) Vapor Density: >1 ( Air = 1 ) Flash Point: 130.00 °F. TCC ( 54.44 °C. ) logP (o/w): 2.590 (est) Shelf Life: 36.00 month(s) or longer if stored properly. Soluble in:   alcohol   water, slightly   water, 480.5 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: tropical green pear apple tropical Odor Description:at 10.00 % in dipropylene glycol. green pear apple tropical Odor and/or flavor descriptions from others (if found). Bedoukian Research ETHYL CIS-3-HEXENOATE (NATURAL) ≥98.0%, Kosher Odor Description:Sharp, pear, green, apple, tropical, good for rind notes, pineapple Use for rind or green notes in fruity applications. Taste Description:green Use in strawberry or in tropicals such as carambola/star fruit, pineapple, fruit punch, rind notes, kiwi, brandy/cognac or wine.   Cosmetic Information: None found   Suppliers: BOC Sciences For experimental / research use only. Ethyl (Z)hex-3-enoate Parchem ethyl (Z)-3-hexenoate Penta International ETHYL CIS-3-HEXENOATE NATURAL Penta International ETHYL CIS-3-HEXENOATE   Safety Information: European information : Most important hazard(s): Xi - Irritant R 10 - Flammable. R 38 - Irritating to skin. S 02 - Keep out of the reach of children. S 24 - Avoid contact with skin. S 36 - Wear suitable protective clothing.   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 Recommendation for ethyl (Z)-3-hexenoate usage levels up to:   2.0000 % in the fragrance concentrate.   Maximised Survey-derived Daily Intakes (MSDI-EU): 120.00 (μg/capita/day) Modified Theoretical Added Maximum Daily Intake (mTAMDI): 800 (μg/person/day) Threshold of Concern: 1800 (μg/person/day) Structure Class: I Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library publication number: 22 Click here to view publication 22   average usual ppm average maximum ppm baked goods: 5.00000 20.00000 beverages(nonalcoholic): 2.00000 10.00000 beverages(alcoholic): 5.00000 20.00000 breakfast cereal: 2.00000 10.00000 cheese: - - chewing gum: 5.00000 25.00000 condiments / relishes: 2.00000 20.00000 confectionery froastings: 5.00000 25.00000 egg products: - - fats / oils: - - fish products: - - frozen dairy: 5.00000 20.00000 fruit ices: 5.00000 20.00000 gelatins / puddings: 5.00000 20.00000 granulated sugar: - - gravies: - - hard candy: 10.00000 40.00000 imitation dairy: 2.00000 10.00000 instant coffee / tea: 2.00000 10.00000 jams / jellies: 5.00000 25.00000 meat products: - - milk products: - - nut products: - - other grains: - - poultry: - - processed fruits: 1.00000 10.00000 processed vegetables: - - reconstituted vegetables: - - seasonings / flavors: 25.00000 100.00000 snack foods: - - soft candy: 10.00000 40.00000 soups: - - sugar substitutes: - - sweet sauces: 2.00000 10.00000   Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i). Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.   average usage mg/kg maximum usage mg/kg Dairy products, excluding products of category 02.0 (01.0): 0.02000 0.40000 Fats and oils, and fat emulsions (type water-in-oil) (02.0): 0.20000 0.40000 Edible ices, including sherbet and sorbet (03.0): 0.20000 4.00000 Processed fruit (04.1): 0.02000 0.40000 Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): 0.02000 0.40000 Confectionery (05.0): 2.00000 40.00000 Chewing gum (05.3): - - Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 0.40000 8.00000 Bakery wares (07.0): 0.20000 4.00000 Meat and meat products, including poultry and game (08.0): 0.02000 0.40000 Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 0.02000 0.40000 Eggs and egg products (10.0): - - Sweeteners, including honey (11.0): - - Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 0.02000 0.40000 Foodstuffs intended for particular nutritional uses (13.0): - - Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 2.00000 40.00000 Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 2.00000 40.00000 Ready-to-eat savouries (15.0): 0.02000 0.40000 Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 0.02000 0.40000   Safety References: European Food Safety Athority(EFSA):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... European Food Safety Authority (EFSA) reference(s): Flavouring Group Evaluation 6, Revision 1 (FGE.06Rev1) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) View page or View pdf Scientific Opinion on Flavouring Group Evaluation 06, Revision 2 (FGE.06Rev2): Straight- and branched-chain aliphatic unsaturated primary alcohols, aldehydes, carboxylic acids, and esters from chemical groups 1 and 4 View page or View pdf Scientific Opinion on Flavouring Group Evaluation 06, Revision 3 (FGE.06Rev3): Straight- and branched-chain aliphatic unsaturated primary alcohols, aldehydes, carboxylic acids, and esters from chemical groups 1 and 4 View page or View pdf Scientific Opinion on Flavouring Group Evaluation 06, Revision 4 (FGE.06Rev4): Straight- and branched-chain aliphatic unsaturated primary alcohols, aldehydes, carboxylic acids and esters from chemical groups 1, 3 and 4 View page or View pdf 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 :5362623 National Institute of Allergy and Infectious Diseases:Data WISER:UN 3272 WGK Germany:2 ethyl (Z)-hex-3-enoate Chemidplus:0064187833   References:   ethyl (Z)-hex-3-enoate NIST Chemistry WebBook: Search Inchi Pubchem (cid): 5362623 Pubchem (sid): 135073259 Pherobase: View   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 FDA Substances Added to Food (formerly EAFUS): View HMDB (The Human Metabolome Database): HMDB32266 FooDB: FDB009389 Export Tariff Code: 2916.19.6000 Typical G.C. VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these 2- ethyl-N-methyl-N-(3-methyl phenyl) butyramide FR chemical chemical propyl propionate FL/FR fatty allyl octanoate FL/FR floral cassis specialty FR citronellyl butyrate FL/FR cyclamen homoaldehyde FR dimethyl benzyl carbinyl acetate FL/FR gardenia absolute FR gardenia fragrance FR gardenia specialty FR greenhouse fragrance FR hexyl 2-furoate FL/FR calla lily fragrance FR lily propanol FR petitgrain oil fractions FR phenethyl butyrate FL/FR fruity allyl cyclohexyl acetate FL/FR amyl acetate FL/FR iso amyl hexanoate FL/FR iso amyl isobutyrate FL/FR apple crotonate FR apple ketal FL/FR apple pear fragrance FR banana fragrance FR iso butyl hexanoate FL/FR butyl isobutyrate FL/FR butyl isovalerate FL/FR butyl valerate FL/FR citronellyl isobutyrate FL/FR cyclohexyl carboxylic acid FL/FR diethyl malonate FL/FR ethyl 2-cyclohexyl propionate FR ethyl 2-methyl butyrate FL/FR ethyl 3-hexenoate FL/FR ethyl 3,5,5-trimethyl hexanoate FR ethyl acetoacetate FL/FR grape butyrate FL/FR green acetate 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 lychee fragrance FR mango fragrance FR mango specialty FR methyl 2-methyl butyrate FL/FR methyl 3-nonenoate FL/FR 2- methyl butyl butyrate FL/FR 2- methyl butyl isovalerate FL/FR methyl octadienoate FL/FR iso propyl 2-methyl butyrate FL/FR propyl 2,4-decadienoate FL/FR propyl heptanoate FL/FR propyl hexanoate FL/FR green ethyl (E,Z)-2,4-decadienoate FL/FR ethyl (E)-2-decenoate FL/FR green note propionate FL/FR (Z)-3- hepten-1-yl acetate FL/FR (Z)-3- hexen-1-yl 2-methyl butyrate FL/FR (Z)-3- hexen-1-yl angelate FR (Z)-3- hexen-1-yl butyrate 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 hexyl isobutyrate FL/FR methyl (E)-3-hexenoate FL/FR 3- octyl formate FL/FR phenoxyethyl isobutyrate FL/FR sorbyl isobutyrate FL/FR (E,E)- sorbyl isobutyrate FL/FR herbal 2- pentyl acetate FL/FR melon (Z)-6- nonen-1-yl acetate FL/FR spicy cinnamyl isovalerate FL/FR sulfurous mango thiol FL/FR (S)-1- methoxy-3-heptane thiol FL/FR tropical 2- tropical oxathiane FL/FR waxy (E)-2- tridecen-1-yl acetate FL/FR For Flavor No flavor group found for these acetone FL 9- decen-2-one FL (Z)-3- hepten-1-yl acetate FL/FR 2- hexenal diethyl acetal FL hexyl propionate FL/FR methyl octadienoate FL/FR (E,E)- sorbyl isobutyrate FL/FR (E)-2- tridecen-1-yl acetate FL/FR sorbyl isobutyrate FL/FR dairy dairy 2- pentyl acetate FL/FR estery ethyl acetoacetate FL/FR ethereal 4- hexen-3-one FL fatty allyl octanoate FL/FR floral dimethyl benzyl carbinyl acetate FL/FR fruity allyl cyclohexyl acetate FL/FR amyl acetate FL/FR iso amyl hexanoate FL/FR iso amyl isobutyrate FL/FR apple ketal FL/FR iso butyl hexanoate FL/FR butyl isobutyrate FL/FR butyl isovalerate FL/FR butyl valerate FL/FR cinnamyl isovalerate FL/FR citronellyl butyrate FL/FR citronellyl isobutyrate FL/FR cyclohexyl carboxylic acid FL/FR diethyl malonate FL/FR ethyl (E)-2-decenoate FL/FR ethyl 2-methyl butyrate FL/FR ethyl 3-hexenoate FL/FR (Z)-3- hexen-1-yl isobutyrate FL/FR hexyl acetate FL/FR (S)-1- methoxy-3-heptane thiol FL/FR methyl (E)-3-nonenoate FL methyl 2-methyl butyrate FL/FR methyl 3-nonenoate FL/FR 2- methyl butyl butyrate FL/FR 2- methyl butyl isovalerate FL/FR (Z)-3- nonen-1-yl acetate FL phenethyl butyrate FL/FR iso propyl 2-methyl butyrate FL/FR propyl hexanoate FL/FR green ethyl (E,Z)-2,4-decadienoate FL/FR grape butyrate FL/FR green note propionate FL/FR (Z)-3- hexen-1-yl 2-methyl butyrate FL/FR (Z)-3- hexen-1-yl butyrate 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- hexenal diethyl acetal FL hexyl (E)-tiglate FL/FR hexyl 2-furoate FL/FR hexyl isobutyrate FL/FR hexyl isovalerate FL/FR methyl (E)-3-hexenoate FL/FR 4- methyl-2-pentenal FL (Z)-6- nonen-1-yl acetate FL/FR phenoxyethyl isobutyrate FL/FR melon propyl 2,4-decadienoate FL/FR sulfurous mango thiol FL/FR methyl 2-(methyl thio) butyrate FL tropical propyl propionate FL/FR 2- tropical oxathiane FL/FR waxy 3- octyl formate FL/FR propyl heptanoate FL/FR   Potential Uses: FR fruit FR green FL tropical   Occurrence (nature, food, other):note   acerola fruit Search Trop Picture   brandy grape brandy Search PMC Picture   guava fruit Search Trop Picture   mango fruit Search Trop Picture   mastic leaf oil @ 0.07% Data GC Search Trop Picture   passion fruit juice - up to 0.15 mg/kg Search Trop Picture   pear fruit Search Trop Picture   pineapple fruit Search Trop Picture   strawberry guava fruit Search Trop Picture   tea leaf Search Trop Picture   Synonyms:   ethyl (3Z)-3-hexenoate   ethyl (3Z)-hex-3-enoate   ethyl (3Z)-hexenoate   ethyl (Z)-hex-3-enoate   ethyl cis-3-hexenoate   ethyl cis-3-hexenoate (natural)   ethyl cis-3-hexenoate natural cis- hex-3-enoic acid ethyl ester 3- hexenoic acid, ethyl ester, (3Z)- 3- hexenoic acid, ethyl ester, (Z)-   Articles:   None found yet. Try the PubMed Search.

Notes: Used as a food additive [EAFUS]