alpha-methyl phenethyl butyrate
alpha-methylphenethyl butyrate

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Name: 1-methyl-2-phenylethyl butanoate CAS Number: 68922-11-2 3D/inchi ECHA EINECS - REACH Pre-Reg: 272-983-6 FDA UNII: IG60Q569XB Nikkaji Web: J332.734E CoE Number: 2276 Molecular Weight: 206.28486000 Formula: C13 H18 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: 814 alpha-methylphenethyl butyrate DG SANTE Food Flavourings: 09.249 1-methyl-2-phenethyl butyrate FEMA Number: 3197 alpha-methylphenethyl butyrate FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 68922-11-2 ; ALPHA-METHYLPHENETHYL BUTYRATE   Physical Properties: Appearance: colorless clear oily liquid (est) Assay: 99.00 to 100.00 Additional Assay Information: racemate Food Chemicals Codex Listed: No Specific Gravity: 0.97500 to 0.98500 @ 25.00 °C. Pounds per Gallon - (est).: 8.113 to 8.196 Refractive Index: 1.48000 to 1.48700 @ 20.00 °C. Boiling Point: 138.00 to 140.00 °C. @ 10.00 mm Hg Boiling Point: 281.00 to 282.00 °C. @ 760.00 mm Hg (est) Acid Value: 1.00 max. KOH/g Vapor Pressure: 0.003000 mmHg @ 25.00 °C. (est) Flash Point: 226.00 °F. TCC ( 107.78 °C. ) logP (o/w): 3.709 (est) Soluble in:   alcohol   water, 16.47 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: Parchem alpha-methyl phenethyl butyrate Chemical Sources Association Need This Item for Flavor/Food?: You can contact the Chemical Sources Association   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   Maximised Survey-derived Daily Intakes (MSDI-EU): 0.12 (μg/capita/day) Maximised Survey-derived Daily Intakes (MSDI-USA): 0.10 (μg/capita/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: 4 Click here to view publication 4   average usual ppm average maximum ppm baked goods: - - beverages(nonalcoholic): - 0.60000 beverages(alcoholic): - - breakfast cereal: - - cheese: - - chewing gum: - - condiments / relishes: - - confectionery froastings: - - egg products: - - fats / oils: - - fish products: - - frozen dairy: - 3.00000 fruit ices: - 3.00000 gelatins / puddings: - 3.00000 granulated sugar: - - gravies: - - hard candy: - 6.00000 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): Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 16 (FGE.16): Aromatic ketones from chemical group 21 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf Flavouring Group Evaluation 16, Revision 1 (FGE.16Rev1)[1]: Aromatic ketones from chemical group 21- Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf Flavouring Group Evaluation 69, (FGE.69)[1] - Consideration of aromatic substituted secondary alcohols, ketones and related esters evaluated by JECFA (57th meeting) structurally related to aromatic ketones from chemical group 21 evaluated by EFSA in FGE.16 (2006) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf Flavouring Group Evaluation 16, Revision 2 (FGE.16Rev2): Aromatic ketones from chemical group 21 View page or View pdf Scientific Opinion on Flavouring Group Evaluation 69, Revision 1 (FGE.69Rev1): consideration of aromatic substituted secondary alcohols, ketones and related esters evaluated by JECFA (57th meeting), structurally related to aromatic ketones from chemical group 21 evaluated by EFSA in FGE.16Rev2 View page or View pdf EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):68922-11-2 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :19857768 National Institute of Allergy and Infectious Diseases:Data 1-methyl-2-phenylethyl butanoate Chemidplus:0068922112   References:   1-methyl-2-phenylethyl butanoate NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 68922-11-2 Pubchem (cid): 19857768 Pubchem (sid): 135268299   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): HMDB36391 FooDB: FDB015269 Export Tariff Code: 2915.60.0000 ChemSpider: View   Potential Blenders and core components note None Found   Potential Uses: None Found   Occurrence (nature, food, other):note   not found in nature   Synonyms:   butanoic acid 1-methyl-2-phenyl ethyl ester   butanoic acid, 1-methyl-2-phenylethyl ester   methyl benzyl carbinyl butyrate 1- methyl-2-phenethyl butyrate 1- methyl-2-phenyl ethyl butanoate 1- methyl-2-phenyl ethyl butyrate 1- methyl-2-phenylethyl butyrate alpha- methylphenethyl butyrate 1- phenyl-2-propyl butyrate 1- phenylpropan-2-yl butyrate   Articles:   None found yet. Try the PubMed Search.

Notes: Flavouring ingredient