sorbyl acetate
2,4-hexadienyl acetate

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  Bedoukian Research, Inc.

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  221 2,4-HEXADIENYL ACETATE ≥98.0%, Kosher
  SDS
  The spicy warm quality of this material can add depth to any fruit flavor, particularly pineapple and tropical flavors.

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  Product(s):
  1516-17-2 2,4-HEXADIENYL ACETATE 98.0%

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  08-21100 2,4-HEXADIENYL ACETATE

Name: hexa-2,4-dienyl acetate CAS Number: 1516-17-2 3D/inchi ECHA EINECS - REACH Pre-Reg: 216-163-8 FDA UNII: 5416SJ1T8T Nikkaji Web: J33.460J MDL: MFCD00036521 CoE Number: 10675 XlogP3-AA: 1.60 (est) Molecular Weight: 140.18204000 Formula: C8 H12 O2 NMR Predictor: Predict (works with chrome, Edge or firefox) EFSA/JECFA Comments: Predominantly E,E Category:flavoring agents and cosmetic 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: 1780 2,4-hexadienyl acetate DG SANTE Food Flavourings: 09.573 hexa-2,4-dienyl acetate FEMA Number: 4132 2,4-hexadienyl acetate FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 1516-17-2 ; 2,4-HEXADIENYL ACETATE   Physical Properties: Appearance: colorless to pale yellow clear liquid (est) Assay: 95.00 to 100.00 sum of isomers Food Chemicals Codex Listed: No Specific Gravity: 0.90800 to 0.91400 @ 25.00 °C. Pounds per Gallon - (est).: 7.555 to 7.605 Refractive Index: 1.47000 to 1.47600 @ 20.00 °C. Boiling Point: 100.00 °C. @ 20.00 mm Hg Boiling Point: 192.00 to 193.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.662000 mmHg @ 25.00 °C. (est) Flash Point: 160.00 °F. TCC ( 71.11 °C. ) logP (o/w): 2.195 (est) Soluble in:   alcohol   triacetin   water, 747.7 mg/L @ 25 °C (est)   Organoleptic Properties: Odor Type: green Odor Strength:medium Substantivity:2 hour(s) at 100.00 % fresh green oily herbal pumpkin fresh parsley Odor Description:at 100.00 %. fresh green oily herbal pumpkin fresh parsley Luebke, William tgsc, (2006) Odor sample from: Sigma-Aldrich Flavor Type: green fresh green herbal soapy metallic Taste Description: at 25.00 ppm in water. fresh green herbal soapy metallic Luebke, William tgsc, (2006) Odor and/or flavor descriptions from others (if found). Bedoukian Research 2,4-HEXADIENYL ACETATE ≥98.0%, Kosher Odor Description:powerful, sweet, pineapple Taste Description:green The spicy warm quality of this material can add depth to any fruit flavor, particularly pineapple and tropical flavors.   Cosmetic Information: CosIng: cosmetic data Cosmetic Uses: perfuming agents   Suppliers: Bedoukian Research 2,4-HEXADIENYL ACETATE sds ≥98.0%, Kosher Odor: powerful, sweet, pineapple Flavor: green The spicy warm quality of this material can add depth to any fruit flavor, particularly pineapple and tropical flavors. BOC Sciences For experimental / research use only. 2,4-HEXADIENYL ACETATE 98.0% Parchem sorbyl acetate Penta International 2,4-HEXADIENYL ACETATE   Safety Information: Preferred SDS: View European information : Most important hazard(s): Xi - Irritant R 36 - Irritating to eyes. R 41 - Risk of serious damage to eyes. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/39 - Wear suitable clothing and eye/face protection.   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: oral-rat LD50 4360 ul/kg Toxicology and Applied Pharmacology. Vol. 28, Pg. 313, 1974. Dermal Toxicity: skin-rabbit LD50 2520 ul/kg Toxicology and Applied Pharmacology. Vol. 28, Pg. 313, 1974. Inhalation Toxicity: Not determined   Safety in Use Information: Category: flavoring agents and cosmetic fragrance agents Recommendation for sorbyl acetate usage levels up to:   not for fragrance use.   Maximised Survey-derived Daily Intakes (MSDI-EU): .0012 (μg/capita/day) Maximised Survey-derived Daily Intakes (MSDI-USA): 0.01 (μg/capita/day) Modified Theoretical Added Maximum Daily Intake (mTAMDI): 1700 (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: 0.50000 10.00000 beverages(nonalcoholic): 2.00000 20.00000 beverages(alcoholic): 2.00000 20.00000 breakfast cereal: 0.50000 10.00000 cheese: - - chewing gum: 5.00000 25.00000 condiments / relishes: - - confectionery froastings: 5.00000 25.00000 egg products: - - fats / oils: - - fish products: - - frozen dairy: 1.00000 20.00000 fruit ices: 1.00000 20.00000 gelatins / puddings: 5.00000 25.00000 granulated sugar: - - gravies: - - hard candy: 1.00000 10.00000 imitation dairy: - - instant coffee / tea: - - jams / jellies: 5.00000 25.00000 meat products: - - milk products: 5.00000 25.00000 nut products: - - other grains: - - poultry: - - processed fruits: 5.00000 25.00000 processed vegetables: - - reconstituted vegetables: - - seasonings / flavors: 1.00000 10.00000 snack foods: 5.00000 25.00000 soft candy: 1.00000 10.00000 soups: - - sugar substitutes: - - sweet sauces: 1.00000 5.00000   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): 5.00000 25.00000 Fats and oils, and fat emulsions (type water-in-oil) (02.0): - - Edible ices, including sherbet and sorbet (03.0): 4.00000 20.00000 Processed fruit (04.1): - - Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): 5.00000 25.00000 Confectionery (05.0): 5.00000 25.00000 Chewing gum (05.3): - - Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 2.00000 10.00000 Bakery wares (07.0): 5.00000 25.00000 Meat and meat products, including poultry and game (08.0): - - Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): - - Eggs and egg products (10.0): - - Sweeteners, including honey (11.0): - - Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 2.00000 10.00000 Foodstuffs intended for particular nutritional uses (13.0): - - Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 2.00000 20.00000 Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 4.00000 20.00000 Ready-to-eat savouries (15.0): 5.00000 25.00000 Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 3.00000 25.00000   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 203: alpha,beta-Unsaturated aliphatic aldehydes and precursors from chemical subgroup 1.1.4 of FGE.19 with two or more conjugated double bonds and with or without additional non-conjugated double bonds View page or View pdf Scientific Opinion on Flavouring Group Evaluation 203, Revision 1 (FGE.203Rev1): a,ß-Unsaturated aliphatic aldehydes and precursors from chemical subgroup 1.1.4 of FGE.19 with two or more conjugated double-bonds and with or without additional non-conjugated double-bonds View page or View pdf Scientific Opinion on Flavouring Group Evaluation 203, Revision 2 (FGE.203Rev2): a,ß-unsaturated aliphatic aldehydes and precursors from chemical subgroup 1.1.4 of FGE.19 with two or more conjugated double-bonds and with or without additional non-conjugated double-bonds View page or View pdf Scientific Opinion on Flavouring Group Evaluation 70, Revision 1 (FGE.70Rev1): consideration of aliphatic, linear, a,ß-unsaturated, di- and trienals and related alcohols, acids and esters evaluated by JECFA (61st-68th-69th meeting) View page or View pdf EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):1516-17-2 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :15196 National Institute of Allergy and Infectious Diseases:Data WISER:UN 1993 WGK Germany:1 hexa-2,4-dienyl acetate Chemidplus:0001516172 RTECS:AI0350000 for cas# 1516-17-2   References:   hexa-2,4-dienyl acetate NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 1516-17-2 Pubchem (cid): 15196 Pubchem (sid): 29283168   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): HMDB32311 FooDB: FDB009559 Export Tariff Code: 2915.39.9500 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View Wikipedia: View   Potential Blenders and core components note For Odor aldehydic iso butyraldehyde FL/FR amber angelica root oil FL/FR anise sweet fennel seed oil FL/FR anisic estragole FL/FR ocimum basilicum herb oil FL/FR ocimum basilicum leaf oil america FL/FR ocimum basilicum leaf oil CO2 extract FL/FR balsamic benzyl salicylate FL/FR cinnamyl formate FL/FR burnt lepidine FL/FR caramellic helichrysum italicum flower absolute FL/FR citrus litsea cubeba oil terpeneless FL/FR valencene FL/FR coconut delta- heptalactone FL/FR earthy heptanal cyclic acetal with glycerol FL/FR 1- octen-3-ol FL/FR ethereal ethyl 4-pentenoate FL/FR fatty (E,Z)-2,6- dodecadienal FL/FR (E)-2- octenal FL/FR floral iso amyl salicylate FL/FR coriander seed oil FL/FR beta- damascenone FL/FR dihydrojasmone FL/FR dimethyl benzyl carbinyl butyrate FL/FR geranium oil africa FL/FR geranium oil egypt FL/FR hexahydrofarnesyl acetone FL/FR methyl jasmonate FL/FR neryl formate FL/FR iso phytol FL/FR prenyl salicylate FL/FR rose absolute (rosa damascena) turkey FL/FR fruity butyl 2-decenoate FL/FR iso butyl octanoate FL/FR octyl butyrate FL/FR iso propyl 2-methyl butyrate FL/FR green iso butyl heptanoate FL/FR iso butyl methyl ketone FL/FR 2-sec- butyl thiazole FL/FR coriander heptenol FL/FR heptanal (aldehyde C-7) FL/FR 1- heptanol FL/FR 1- hepten-3-ol FL/FR (Z)-4- heptenal diethyl acetal FL/FR (Z)-4- hexen-1-ol FL/FR (Z)-3- hexen-1-ol FL/FR (Z)-3- hexen-1-yl pyruvate FL/FR 3- hexenyl 2-methyl butyrate FL/FR hexyl tiglate FL/FR melon acetal FL/FR 6- methyl-3-hepten-2-one FL/FR olive oil absolute FL/FR seaweed absolute (fucus vesiculosus et serratus) FL/FR herbal 6- acetoxydihydrotheaspirane FL/FR alpha- amyl cinnamyl formate FL/FR anethum graveolens herb oil FL/FR anthemis nobilis flower extract FL/FR anthemis nobilis flower oil roman FL/FR apium graveolens seed oil FL/FR sweet basil absolute FL/FR (+)-alpha- campholenic aldehyde FL/FR celery ketone FL/FR 1,4- cineole FL/FR clary sage oil france FL/FR coriander oleoresin FL/FR dill weed oil cuba FL/FR dill weed oil reunion FL/FR dimethyl benzyl carbinyl formate FL/FR hexyl salicylate FL/FR hop absolute FL/FR hop oil FL/FR hyssop oil FL/FR linalyl formate FL/FR linalyl octanoate FL/FR marigold oil mexico FL/FR matricaria chamomilla flower oil FL/FR melaleuca leucadendron var. cajuputi leaf oil FL/FR 5- methyl-3-heptanone FL/FR (E)-6- methyl-3-hepten-2-one FL/FR 1- octen-3-yl acetate FL/FR origanum oil FL/FR origanum oil greece FL/FR curled parsley seed oil FL/FR laevo- perillaldehyde FL/FR perillaldehyde FL/FR rosmarinus officinalis extract FL/FR rosmarinus officinalis tincture FL/FR salvia sclarea oil FL/FR tagete oil CO2 extract FL/FR tagete oil south africa FL/FR theaspirane FL/FR thyme absolute FL/FR viridiflorol FL/FR wormwood oil america FL/FR melon melon heptenal FL/FR minty (-)- menthone FL/FR (-)-iso pulegol FL/FR mossy oakmoss absolute FL/FR oakmoss distillates FL/FR spicy iso butyl angelate FL/FR (-)- cubenol FL/FR cuminaldehyde FL/FR waxy octyl isobutyrate FL/FR woody sabinene FL/FR For Flavor No flavor group found for these 6- acetoxydihydrotheaspirane FL/FR alpha- amyl cinnamyl formate FL/FR iso butyl heptanoate FL/FR iso butyl octanoate FL/FR 4- butyl thiazole FL 2-sec- butyl thiazole FL/FR coriander heptenol FL/FR dimethyl benzyl carbinyl formate FL/FR ethyl 4-pentenoate FL/FR fig leaf absolute FL heptanal cyclic acetal with glycerol FL/FR (E,E)-2,4- hexadien-1-ol FL melaleuca leucadendron var. cajuputi leaf oil FL/FR 6- methyl-3-hepten-2-one FL/FR (E)-6- methyl-3-hepten-2-one FL/FR 3- pentanol FL 2- propyl thiazole FL seaweed absolute (fucus vesiculosus et serratus) FL/FR viridiflorol FL/FR absinthe absinthe absinthe flavor FL aldehydic iso butyraldehyde FL/FR anise sweet fennel seed oil FL/FR aromatic laevo- perillaldehyde FL/FR balsamic benzyl salicylate FL/FR citrus valencene FL/FR cooling 1,4- cineole FL/FR theaspirane FL/FR creamy octyl isobutyrate FL/FR fatty (E,E)-2,4- decadienal FL (E,E)-2,4- heptadienal FL (E)-2- octenal FL/FR floral dihydrojasmone FL/FR dimethyl benzyl carbinyl butyrate FL/FR geranium oil africa FL/FR geranium oil egypt FL/FR lepidine FL/FR methyl jasmonate FL/FR rose absolute (rosa damascena) turkey FL/FR fruity butyl 2-decenoate FL/FR linalyl octanoate FL/FR 5- methyl-3-heptanone FL/FR neryl formate FL/FR iso propyl 2-methyl butyrate FL/FR tagete oil CO2 extract FL/FR tagete oil south africa FL/FR green aloe vera flavor FL iso amyl salicylate FL/FR angelica root oil FL/FR iso butyl angelate FL/FR iso butyl methyl ketone FL/FR (+)-alpha- campholenic aldehyde FL/FR celery ketone FL/FR (E,Z)-2,6- dodecadienal FL/FR helichrysum italicum flower absolute FL/FR heptanal (aldehyde C-7) FL/FR 1- hepten-3-ol FL/FR (Z)-4- heptenal diethyl acetal FL/FR hexahydrofarnesyl acetone FL/FR (Z)-4- hexen-1-ol FL/FR (Z)-3- hexen-1-ol FL/FR (Z)-3- hexen-1-yl pyruvate FL/FR 3- hexenyl 2-methyl butyrate FL/FR hexyl tiglate FL/FR lettuce flavor FL melon acetal FL/FR melon heptenal FL/FR oakmoss absolute FL/FR 1- octen-3-yl acetate FL/FR herbal anethum graveolens herb oil FL/FR anthemis nobilis flower extract FL/FR anthemis nobilis flower oil roman FL/FR apium graveolens seed oil FL/FR sweet basil absolute FL/FR celery flavor FL celery seed oil distillates FL cilantro flavor FL clary sage oil france FL/FR clover herb distillate (melilotus officinalis) FL coriander oleoresin FL/FR coriander seed oil FL/FR dill flavor FL dill weed oil cuba FL/FR dill weed oil reunion FL/FR hexyl salicylate FL/FR hop absolute FL/FR hop oil FL/FR hyssop oil FL/FR linalyl formate FL/FR marigold oil mexico FL/FR matricaria chamomilla flower oil FL/FR ocimum basilicum herb oil FL/FR ocimum basilicum leaf oil america FL/FR ocimum basilicum leaf oil CO2 extract FL/FR origanum oil FL/FR origanum oil greece FL/FR curled parsley seed oil FL/FR curled parsley seed oleoresin FL prenyl salicylate FL/FR rosmarinus officinalis extract FL/FR rosmarinus officinalis tincture FL/FR salvia sclarea oil FL/FR thyme absolute FL/FR wormwood oil america FL/FR lactonic delta- heptalactone FL/FR lemon litsea cubeba oil terpeneless FL/FR licorice estragole FL/FR minty (-)- menthone FL/FR (-)-iso pulegol FL/FR mossy oakmoss distillates FL/FR mushroom 1- octen-3-ol FL/FR oily olive oil absolute FL/FR iso phytol FL/FR solvent 1- heptanol FL/FR spicy cinnamyl formate FL/FR (-)- cubenol FL/FR cumin oleoresin FL cuminaldehyde FL/FR geranium flavor FL perillaldehyde FL/FR waxy octyl butyrate FL/FR woody beta- damascenone FL/FR sabinene FL/FR   Potential Uses: FR fruit FL green FL herbal FL mango FL/FR parsley leaf FR passion fruit FL pineapple FL pumpkin FL tropical FL vegetable   watercress nasturtium FL wine   Occurrence (nature, food, other):note   found in nature   Synonyms:   acetic acid 2,4-hexadien-1-ol ester   acetic acid 2,4-hexadien-1-yl ester   hexa-2,4-dien-1-yl acetate   hexa-2,4-dienyl acetate 2,4- hexadien-1-ol, acetate 2,4- hexadien-1-yl acetate 2,4- hexadienyl acetate   sorbyl acetate   Articles:   None found yet. Try the PubMed Search.

Notes: Used as a food additive [EAFUS]