4-methyl pentyl 4-methyl valerate
4-methylpentyl 4-methylvalerate

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  W474900 4-Methylpentyl 4-methylvalerate, ≥95%
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Name: 4-methylpentyl 4-methylpentanoate CAS Number: 35852-42-7 3D/inchi FDA UNII: CI3RHY3QTP Nikkaji Web: J504.902D XlogP3-AA: 3.80 (est) Molecular Weight: 200.32168000 Formula: C12 H24 O2 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 Google Patents: Search US Patents: Search EU Patents: Search Pubchem Patents: Search PubMed: Search NCBI: Search FEMA Number: 4749 4-methylpentyl 4-methylvalerate FDA: No longer provide for the use of these seven synthetic flavoring substances   Physical Properties: Appearance: colorless to pale yellow clear liquid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Boiling Point: 222.02 °C. @ 760.00 mm Hg (est) Vapor Pressure: 0.104000 mmHg @ 25.00 °C. (est) Flash Point: 197.00 °F. TCC ( 91.80 °C. ) (est) logP (o/w): 4.591 (est) Soluble in:   alcohol   water, 4.696 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: fruity fruity waxy soapy herbal Odor Description:at 10.00 % in dipropylene glycol. fruity waxy soapy herbal Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: Sigma-Aldrich 4-Methylpentyl 4-methylvalerate, ≥95% sds Certified Food Grade Products Chemical Sources Association Need This Item for Flavor/Food?: You can contact the Chemical Sources Association   Safety Information: Preferred SDS: View   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 4-methyl pentyl 4-methyl valerate 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: 26 Click here to view publication 26   average usual ppm average maximum ppm baked goods: 4.00000 30.00000 beverages(nonalcoholic): 4.00000 30.00000 beverages(alcoholic): 4.00000 30.00000 breakfast cereal: 4.00000 30.00000 cheese: 4.00000 30.00000 chewing gum: 10.00000 80.00000 condiments / relishes: 4.00000 30.00000 confectionery froastings: 4.00000 30.00000 egg products: - - fats / oils: - - fish products: - - frozen dairy: 4.00000 30.00000 fruit ices: 4.00000 30.00000 gelatins / puddings: 4.00000 30.00000 granulated sugar: 4.00000 30.00000 gravies: - - hard candy: 4.00000 30.00000 imitation dairy: - - instant coffee / tea: 4.00000 30.00000 jams / jellies: 4.00000 30.00000 meat products: - - milk products: - - nut products: 4.00000 30.00000 other grains: - - poultry: - - processed fruits: 4.00000 30.00000 processed vegetables: - - reconstituted vegetables: - - seasonings / flavors: 4.00000 30.00000 snack foods: 4.00000 30.00000 soft candy: 4.00000 30.00000 soups: - - sugar substitutes: - - sweet sauces: 4.00000 30.00000   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 :88168807 National Institute of Allergy and Infectious Diseases:Data WGK Germany:3 4-methylpentyl 4-methylpentanoate Chemidplus:0035852427   References:   4-methylpentyl 4-methylpentanoate NIST Chemistry WebBook: Search Inchi Pubchem (cid): 88168807 Pubchem (cas): 35852-42-7   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 HMDB (The Human Metabolome Database): Search VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note For Odor aldehydic dodecanal (aldehyde C-12 lauric) FL/FR undecanal FL/FR citrus 10- undecen-1-ol FL/FR dairy methyl butyl phenyl acetate FL/FR fatty allyl octanoate FL/FR iso butyl undecylenate FL/FR methyl 10-undecenoate FL/FR floral citronellyl propionate FL/FR dimethyl octanol FL/FR gelsone (IFF) FL/FR (E)- geranyl acetone FL/FR geranyl hexanoate FL/FR jasmin absolute egypt (from concrete) FL/FR methyl citronellate FL/FR octyl acetate FL/FR fruity allyl 10-undecenoate FL/FR allyl heptanoate FL/FR iso amyl isobutyrate FL/FR iso amyl octanoate FL/FR decyl butyrate FL/FR dimethyl succinate FL/FR ethyl hexanoate FL/FR 3- hexanone FL/FR methyl (E,Z)-2,4-decadienoate FL/FR 2- nonanone FL/FR (E)-2- nonen-1-yl acetate FL/FR octyl butyrate FL/FR 2- undecanone FL/FR green ethyl (E)-2-decenoate FL/FR ethyl (E)-4-decenoate FL/FR (Z)-3- hexen-1-yl propionate FL/FR hexyl 2-methyl butyrate FL/FR hexyl butyrate FL/FR hexyl phenyl acetate FL/FR herbal butyl levulinate FL/FR cardamom oleoresin FL/FR musk iso ambrettolide FL/FR soapy benzyl laurate FL/FR ethyl undecanoate FL/FR vegetable 1- furfuryl pyrrole FL/FR waxy allyl nonanoate FL/FR butyl laurate FL/FR 3- decanone FL/FR dihydrocitronellyl acetate FL/FR 1- dodecanol FL/FR ethyl decanoate FL/FR ethyl palmitate FL/FR heptyl octanoate FL/FR methyl laurate FL/FR (E)-2- octen-1-yl butyrate FL/FR octyl 2-methyl butyrate FL/FR octyl isobutyrate FL/FR propyl decanoate FL/FR (E)-2- tridecen-1-yl acetate FL/FR For Flavor No flavor group found for these allyl 10-undecenoate FL/FR iso butyl undecylenate FL/FR 3- decanone FL/FR dihydrocitronellyl acetate FL/FR methyl (E,Z)-2,4-decadienoate FL/FR (E)-2- octen-1-yl butyrate FL/FR propyl decanoate FL/FR (E)-2- tridecen-1-yl acetate FL/FR 10- undecen-1-ol FL/FR cheesy cheesy 2- nonanone FL/FR coconut (R)- massoia lactone FL creamy octyl isobutyrate FL/FR dairy methyl butyl phenyl acetate FL/FR ethereal benzyl laurate FL/FR fatty allyl octanoate FL/FR dimethyl octanol FL/FR ethyl (E)-4-decenoate FL/FR floral citronellyl propionate FL/FR (E)- geranyl acetone FL/FR jasmin absolute egypt (from concrete) FL/FR methyl citronellate FL/FR fruity allyl heptanoate FL/FR iso amyl isobutyrate FL/FR iso amyl octanoate FL/FR decyl butyrate FL/FR dimethyl succinate FL/FR ethyl (E)-2-decenoate FL/FR ethyl hexanoate FL/FR geranyl hexanoate FL/FR 3- hexanone FL/FR hexyl phenyl acetate FL/FR green gelsone (IFF) FL/FR (Z)-3- hexen-1-yl propionate FL/FR (E)-3- hexenoic acid FL hexyl 2-methyl butyrate FL/FR hexyl butyrate FL/FR methyl 2-undecynoate FL herbal butyl levulinate FL/FR cardamom oleoresin FL/FR musk iso ambrettolide FL/FR soapy dodecanal (aldehyde C-12 lauric) FL/FR 1- dodecanol FL/FR vegetable 1- furfuryl pyrrole FL/FR waxy allyl nonanoate FL/FR butyl laurate FL/FR ethyl decanoate FL/FR ethyl palmitate FL/FR ethyl undecanoate FL/FR heptyl octanoate FL/FR methyl 10-undecenoate FL/FR methyl laurate FL/FR (E)-2- nonen-1-yl acetate FL/FR octyl 2-methyl butyrate FL/FR octyl acetate FL/FR octyl butyrate FL/FR undecanal FL/FR 2- undecanone FL/FR   Potential Uses: None Found   Occurrence (nature, food, other):note   capsicum pubescens Search Trop Picture   chili amarillo chili Search Trop Picture   Synonyms: 4- methyl pentyl 4-methyl pentanoate 4- methylpentanoic acid, 4-methylpentyl ester 4- methylpentyl 4-methylpentanoate 4- methylpentyl 4-methylvalerate   pentanoic acid, 4-methyl-, 4-methylpentyl ester   Articles:   None found yet. 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Notes: None found