2-methyl allyl butyrate
2-methylallyl butyrate

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  BOC Sciences

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  Product(s):
  7149-29-3 2-Methylallyl Butyrate

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  R C Treatt and Co Ltd

  Innovative ingredient solutions
  World-leading innovative ingredient solutions provider for the flavour, fragrance and FMCG industries.
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  Product(s):
  2-Methallyl butyrate

Name: 2-methylprop-2-enyl butanoate CAS Number: 7149-29-3 3D/inchi ECHA EINECS - REACH Pre-Reg: 230-474-6 FDA UNII: 3HSQ94YKHE Nikkaji Web: J183.072D CoE Number: 572 XlogP3-AA: 2.20 (est) Molecular Weight: 142.19798000 Formula: C8 H14 O2 NMR Predictor: Predict (works with chrome, Edge or firefox) EFSA/JECFA Comments: Substance not supported by industry Category:flavoring 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: 1207 2-methylallyl butyrate FEMA Number: 2678 2-methylallyl butyrate FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 7149-29-3 ; 2-METHYLALLYL BUTYRATE FDA Regulation: FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION Subpart F--Flavoring Agents and Related Substances Sec. 172.515 Synthetic flavoring substances and adjuvants.   Physical Properties: Appearance: colorless clear liquid (est) Assay: 97.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.87300 to 0.88300 @ 25.00 °C. Pounds per Gallon - (est).: 7.264 to 7.347 Refractive Index: 1.42200 to 1.42800 @ 20.00 °C. Boiling Point: 168.00 °C. @ 760.00 mm Hg Vapor Pressure: 1.470000 mmHg @ 25.00 °C. (est) Flash Point: 148.00 °F. TCC ( 64.44 °C. ) logP (o/w): 2.527 (est) Soluble in:   alcohol   water, 368.6 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: fruity fruity ethereal Odor Description:at 10.00 % in dipropylene glycol. powerful fruity ether Flavor Type: fruity sweet pineapple apple plum Taste Description: sweet pineapple apple plum Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: BOC Sciences For experimental / research use only. 2-Methylallyl Butyrate Parchem 2-methyl allyl butyrate R C Treatt & Co Ltd 2-Methallyl butyrate   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: flavoring agents Recommendation for 2-methyl allyl butyrate usage levels up to:   not for fragrance use.   Maximised Survey-derived Daily Intakes (MSDI-EU): ND (μg/capita/day) Maximised Survey-derived Daily Intakes (MSDI-USA): 0.20 (μg/capita/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: 3 Click here to view publication 3   average usual ppm average maximum ppm baked goods: - 0.20000 beverages(nonalcoholic): - 0.20000 beverages(alcoholic): - - breakfast cereal: - - cheese: - - chewing gum: - - condiments / relishes: - - confectionery froastings: - - egg products: - - fats / oils: - - fish products: - - frozen dairy: - - fruit ices: - - gelatins / puddings: - - granulated sugar: - - gravies: - - hard candy: - - imitation dairy: - - instant coffee / tea: - - jams / jellies: - - meat products: - - milk products: - - nut products: - - other grains: - - poultry: - - processed fruits: - - processed vegetables: - - reconstituted vegetables: - - seasonings / flavors: - - snack foods: - - soft candy: - - soups: - - sugar substitutes: - - sweet sauces: - -   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): List of apha, beta-Unsaturated Aldehydes and Ketones representative of FGE.19 substances for Genotoxicity Testing [1] - Statement of the Panel on Food Contact Materials, Enzymes, Flavourings and Processing Aids (CEF) View page or View pdf Flavouring Group Evaluation 201: 2-Alkylated aliphatic acyclic alpha,beta-unsaturated aldehydes and precursors with or without additional double bonds from chemical subgroup 1.1.2 of FGE.19[1] View page or View pdf Scientific Opinion on Flavouring Group Evaluation 201 Revision 1 (FGE.201Rev1): 2-Alkylated, aliphatic, acyclic alpha,beta-unsaturated aldehydes and precursors, with or without additional double-bonds, from chemical subgroup 1.1.2 of FGE.19. View page or View pdf Scientific Opinion on Flavouring Group Evaluation 201 Revision 2 (FGE.201Rev2): 2-alkylated, aliphatic, acyclic alpha,beta-unsaturated aldehydes and precursors, with or without additional double-bonds, from chemical subgroup 1.1.2 of FGE.19 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 :251530 National Institute of Allergy and Infectious Diseases:Data 2-methylprop-2-enyl butanoate Chemidplus:0007149293   References:   2-methylprop-2-enyl butanoate NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 7149-29-3 Pubchem (cid): 251530 Pubchem (sid): 135264471   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): HMDB36236 FooDB: FDB015094 Export Tariff Code: 2915.60.0000 ChemSpider: View   Potential Blenders and core components note For Odor alcoholic fusel oil FL/FR chemical iso butyl formate FL/FR ethereal acetal FL/FR butyl acetate FL/FR ethyl acetate FL/FR ethyl pyruvate FL/FR methyl acetate FL/FR methyl ethyl ketone FL/FR 2- methyl valeraldehyde FL/FR iso propyl acetate FL/FR propyl valerate FL/FR iso valeraldehyde propylene glycol acetal FL/FR floral nonan-3-yl acetate FL/FR fruity acetaldehyde diisoamyl acetal FL/FR amyl acetate FL/FR amyl formate FL/FR amyl heptanoate FL/FR benzyl methyl ether FL/FR iso butyl acetate FL/FR iso butyl butyrate FL/FR iso butyl valerate FL/FR diethyl malonate FL/FR 2- ethyl butyl acetate FL/FR ethyl propionate FL/FR geranyl ethyl ether FL/FR methyl 2-methyl butyrate FL/FR methyl 4-methyl valerate FL/FR methyl butyrate FL/FR methyl hexanoate FL/FR methyl isobutyrate FL/FR methyl isovalerate FL/FR 2- pentanone FL/FR pineapple pentenoate FL/FR iso propyl 2-methyl butyrate FL/FR iso propyl butyrate FL/FR iso propyl propionate FL/FR styralyl butyrate FL/FR green cognac heptanone FL/FR (E)-2- hexen-1-yl valerate FL/FR methyl (E)-3-hexenoate FL/FR (Z)-2- penten-1-ol FL/FR herbal linalyl isovalerate FL/FR For Flavor No flavor group found for these acetaldehyde diisoamyl acetal FL/FR butyl methyl ketone FL ethyl 2-methyl-2-(methyl thio) propionate FL geranyl ethyl ether FL/FR 2- heptenoic acid FL 2- methyl butyl isobutyrate FL 2- methyl butyl propionate FL S-( methyl thio) hexanoate FL nonan-3-yl acetate FL/FR propyl valerate FL/FR chemical chemical methyl ethyl ketone FL/FR citrus cognac heptanone FL/FR ethereal butyl acetate FL/FR ethyl acetate FL/FR methyl acetate FL/FR methyl isobutyrate FL/FR iso propyl acetate FL/FR fruity amyl acetate FL/FR amyl formate FL/FR amyl heptanoate FL/FR benzyl methyl ether FL/FR iso butyl acetate FL/FR iso butyl butyrate FL/FR iso butyl valerate FL/FR diethyl malonate FL/FR 2- ethyl butyl acetate FL/FR ethyl propionate FL/FR furfuryl valerate FL fusel oil FL/FR linalyl isovalerate FL/FR methyl 2-methyl butyrate FL/FR methyl 4-methyl valerate FL/FR methyl hexanoate FL/FR methyl isovalerate FL/FR 2- pentanone FL/FR pineapple pentenoate FL/FR iso propyl 2-methyl butyrate FL/FR iso propyl butyrate FL/FR iso propyl propionate FL/FR styralyl butyrate FL/FR iso valeraldehyde propylene glycol acetal FL/FR fusel methyl butyrate FL/FR green 2- ethyl butyraldehyde FL (E)-2- hexen-1-yl valerate FL/FR methyl (E)-3-hexenoate FL/FR (Z)-2- penten-1-ol FL/FR nutty acetal FL/FR pungent acetaldehyde FL rummy iso butyl formate FL/FR ethyl pyruvate FL/FR vegetable 2- methyl valeraldehyde FL/FR   Potential Uses: FL apple FR fruit FL plum   Occurrence (nature, food, other):note   not found in nature   Synonyms:   butanoic acid 2-methyl-2-propenyl ester   butanoic acid, 2-methyl-2-propen-1-yl ester   butanoic acid, 2-methyl-2-propenyl ester   butyric acid 2-methyl allyl ester   butyric acid, 2-methylallyl ester 2- methallyl butyrate 2- methyl allyl butanoate 2- methyl-2-propen-1-yl butyrate 2- methyl-2-propenyl butanoate 2- methyl-2-propenyl butyrate 2- methylallyl butyrate 2- methylprop-2-en-1-yl butyrate 2- methylprop-2-enyl butanoate   Articles:   None found yet. 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Notes: Flavouring ingredient