laevo-menthyl acetoacetate
L-menthyl acetoacetate

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Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] 3-oxobutanoate CAS Number: 59557-05-0 3D/inchi FDA UNII: 7Y94FXH95P Nikkaji Web: J1.290.054F Beilstein Number: 4679794 XlogP3-AA: 3.40 (est) Molecular Weight: 240.34288000 Formula: C14 H24 O3 NMR Predictor: Predict (works with chrome, Edge or firefox) Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 3-oxobutanoate CAS Number: 59557-05-0 (RSR) 3D/inchi FDA UNII: Search Beilstein Number: 4679794 XlogP3-AA: 3.40 (est) Molecular Weight: 240.34288000 Formula: C14 H24 O3 NMR Predictor: Predict (works with chrome, Edge or firefox) 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: 1854 L-menthyl acetoacetate FEMA Number: 4327 L-menthyl acetoacetate FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 59557-05-0 ; L-MENTHYL ACETOACETATE   Physical Properties: Appearance: colorless to pale yellow clear liquid (est) Assay: 96.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.97900 to 0.98500 @ 25.00 °C. Pounds per Gallon - (est).: 8.146 to 8.196 Refractive Index: 1.45800 to 1.46600 @ 20.00 °C. Boiling Point: 110.00 to 115.00 °C. @ 2.20 mm Hg Vapor Pressure: 0.001000 mmHg @ 25.00 °C. (est) Flash Point: 265.00 °F. TCC ( 129.44 °C. ) logP (o/w): 3.764 (est) Soluble in:   alcohol   water, slightly   water, 39.14 mg/L @ 25 °C (est) Insoluble in:   water Similar Items:note amyl acetoacetate isoamyl acetoacetate para-anisyl acetoacetate benzyl acetoacetate bergamot acetoacetate butyl acetoacetate isobutyl acetoacetate cinnamyl acetoacetate cyclohexyl acetoacetate dodecyl acetoacetate ethyl 2-ethyl acetoacetate ethyl acetoacetate geranyl acetoacetate heptyl acetoacetate (Z)-3-hexen-1-yl acetoacetate hexyl acetoacetate jasmin acetoacetate methyl acetoacetate spicy acetoacetate   Organoleptic Properties: Odor Description:minty Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: Axsyn For experimental / research use only. Butanoic acid, 3-oxo-,(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester Nagar Haveli Perfumes & Aromatics laevo-Menthyl Acetoacetate Odor: Minty   Safety Information: 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: oral-rat LD50 > 5000 mg/kg Food and Chemical Toxicology. Vol. 20, Pg. 733, 1982. Dermal Toxicity: skin-rabbit LD50 > 5000 mg/kg Food and Chemical Toxicology. Vol. 20, Pg. 733, 1982. Inhalation Toxicity: Not determined   Safety in Use Information: Category: flavoring agents Recommendation for laevo-menthyl acetoacetate usage levels up to:   not for fragrance use.   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: 23 Click here to view publication 23   average usual ppm average maximum ppm baked goods: 100.00000 200.00000 beverages(nonalcoholic): 50.00000 200.00000 beverages(alcoholic): 50.00000 300.00000 breakfast cereal: 100.00000 200.00000 cheese: - - chewing gum: 1000.00000 6000.00000 condiments / relishes: - - confectionery froastings: 50.00000 100.00000 egg products: - - fats / oils: - - fish products: - - frozen dairy: 100.00000 200.00000 fruit ices: 100.00000 200.00000 gelatins / puddings: 100.00000 200.00000 granulated sugar: - - gravies: - - hard candy: 200.00000 1000.00000 imitation dairy: - - instant coffee / tea: 25.00000 100.00000 jams / jellies: - - meat products: - - milk products: - - nut products: - - other grains: - - poultry: - - processed fruits: 100.00000 200.00000 processed vegetables: - - reconstituted vegetables: - - seasonings / flavors: 100.00000 1000.00000 snack foods: 100.00000 200.00000 soft candy: 300.00000 1000.00000 soups: - - sugar substitutes: - - sweet sauces: - -   Safety References: 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 :43045 National Institute of Allergy and Infectious Diseases:Data WGK Germany:2 [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] 3-oxobutanoate Chemidplus:0059557050 [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 3-oxobutanoate   References: Leffingwell: Chirality or Article   [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] 3-oxobutanoate NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 59557-05-0 Pubchem (cid): 43045 Pubchem (sid): 135006281   [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 3-oxobutanoate NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 59557-05-0 Pubchem (cid): 11413787 Pubchem (sid): 42492904   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): HMDB32369 FooDB: FDB009783 Export Tariff Code: 2915.39.9050 ChemSpider: View   Potential Blenders and core components note None Found   Potential Uses: None Found   Occurrence (nature, food, other):note   not found in nature   Synonyms: (1theta- (1alpha,2beta,5alpha)-3-oxo- butanoic acid methyl-2-(1-methyl ethyl) cyclohexyl ester   butanoic acid, 3-oxo-,(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester L- menthol acetoacetate laevo- menthol acetoacetate L- menthyl acetoacetate [(1S,2R,5S)-5- methyl-2-propan-2-ylcyclohexyl] 3-oxobutanoate   ultracool 7   Articles: Google Patents:Process for producing (3S)-I-menthyl 3-hydroxybutyrate and sensate composition US Patents:8,487,130 - Menthylcarboxamides and their use as cooling agents

Notes: Used as a food additive [EAFUS]

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