nonyl isovalerate
isovaleric acid, nonyl ester

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  BOC Sciences

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  Product(s):
  7786-47-2 Nonyl Isovalerate

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  Synerzine, Inc.

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  Product(s):
  W1419 Nonyl Isovalerate

Name: nonyl 3-methylbutanoate CAS Number: 7786-47-2 3D/inchi ECHA EINECS - REACH Pre-Reg: 232-098-8 FDA UNII: SXP0UF66RQ Nikkaji Web: J183.051A MDL: MFCD00672796 CoE Number: 447 XlogP3: 5.20 (est) Molecular Weight: 228.37556000 Formula: C14 H28 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: 201 nonyl isovalerate DG SANTE Food Flavourings: 09.452 nonyl isovalerate FEMA Number: 2791 nonyl isovalerate FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 7786-47-2 ; NONYL ISOVALERATE 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: 98.00 to 100.00 Food Chemicals Codex Listed: No Boiling Point: 264.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.009000 mmHg @ 25.00 °C. (est) Flash Point: 239.00 °F. TCC ( 115.00 °C. ) logP (o/w): 5.724 (est) Soluble in:   alcohol   dipropylene glycol   water, 0.4196 mg/L @ 25 °C (est) Insoluble in:   water Similar Items:note allyl valerate allyl isovalerate amyl valerate amyl isovalerate isoamyl valerate isoamyl isovalerate para-anisyl isovalerate para-anisyl valerate benzyl valerate benzyl isovalerate bornyl valerate bornyl isovalerate (-)-bornyl isovalerate isobornyl isovalerate S-sec-butyl thioisovalerate butyl valerate butyl isovalerate isobutyl valerate isobutyl isovalerate carvyl isovalerate cinnamyl valerate cinnamyl isovalerate citronellyl valerate citronellyl isovalerate para-cresyl valerate para-cresyl isovalerate cyclohexyl valerate cyclohexyl isovalerate cyclotene isovalerate decyl valerate decyl isovalerate ethyl valerate ethyl isovalerate eugenyl isovalerate furfuryl isovalerate furfuryl valerate geranyl valerate geranyl isovalerate (E)-2-hepten-1-yl isovalerate heptyl isovalerate sec-heptyl isovalerate heptyl valerate (E)-2-hexen-1-yl valerate (E)-2-hexen-1-yl isovalerate (Z)-3-hexen-1-yl valerate (Z)-3-hexen-1-yl isovalerate hexyl valerate hexyl isovalerate linalyl valerate linalyl isovalerate menthyl valerate menthyl isovalerate methyl 2-methyl valerate methyl 4-methyl valerate 2-methyl butyl isovalerate 4-methyl pentyl isovalerate methyl thio isovalerate methyl valerate methyl isovalerate myrtenyl isovalerate neryl isovalerate nonyl valerate octyl valerate octyl isovalerate phenethyl isovalerate 2-phenethyl valerate 3-phenyl propyl isovalerate phenyl propyl valerate S-prenyl thioisovalerate isopropyl thioisovalerate propyl valerate propyl isovalerate isopropyl valerate isopropyl isovalerate rhodinyl isovalerate terpinyl isovalerate terpinyl valerate   Organoleptic Properties: Odor Type: fruity fruity apple hazelnut citrus Odor Description:at 100.00 %. fruity apple hazelnut citrus Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: BOC Sciences For experimental / research use only. Nonyl Isovalerate Synerzine Nonyl Isovalerate   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 Recommendation for nonyl isovalerate usage levels up to:   1.0000 % in the fragrance concentrate.   Maximised Survey-derived Daily Intakes (MSDI-EU): 0.012 (μg/capita/day) 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: - 1.40000 beverages(nonalcoholic): 0.50000 1.00000 beverages(alcoholic): - - breakfast cereal: - - cheese: - - chewing gum: - - condiments / relishes: - - confectionery froastings: - - egg products: - - fats / oils: - - fish products: - - frozen dairy: - 0.50000 fruit ices: - 0.50000 gelatins / puddings: - - granulated sugar: - - gravies: - - hard candy: 1.00000 2.00000 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): Flavouring Group Evaluation 1, Revision 1 (FGE.01Rev 1): Branched-chain aliphatic saturated aldehydes, carboxylic acids and related esters of primary alcohols and branched-chain carboxylic acids from chemical groups 1 and 2 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) on a request from the Commission View page or View pdf Flavouring Group Evaluation 01 Rev2 (FGE.01 Rev2): Branched-chain aliphatic saturated aldehydes, carboxylic acids and related esters of primary alcohols and branched-chain carboxylic acids from chemical groups 1 and 2 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 :5463914 National Institute of Allergy and Infectious Diseases:Data nonyl 3-methylbutanoate Chemidplus:0007786472   References:   nonyl 3-methylbutanoate NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 7786-47-2 Pubchem (cid): 5463914 Pubchem (sid): 135263082   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): HMDB38034 FooDB: FDB017244 Export Tariff Code: 2915.60.0000 ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these (Z)-8- tetradecenal FL/FR aldehydic aldehydic (Z)-4- dodecenal FL/FR camphoreous butyrophenone FL/FR chocolate 2- methoxy-3-methyl pyrazine FL/FR 2,4,5- trimethyl thiazole FL/FR citrus 2- dodecanone FL/FR cocoa 2-iso butyl-3,5-(and 3,6)-dimethyl pyrazine FL/FR fatty 3- decen-2-one FL/FR fermented hexanal diethyl acetal FL/FR floral apple blossom fragrance FR citronellyl acetate FL/FR gamma- damascone FR alpha- damascone FL/FR (Z)-alpha- damascone FL/FR methyl citronellate FL/FR neryl isovalerate FL/FR terpinyl formate FL/FR (E)-2,5,9- trimethyl-4,9-decadien-1-al FR fruity acetaldehyde hexyl isoamyl acetal FL/FR allyl heptanoate FL/FR allyl propionate FL/FR amyl 2-methyl butyrate FL/FR iso amyl 2-methyl butyrate FL/FR amyl isobutyrate FL/FR amyl isovalerate FL/FR iso amyl valerate FL/FR apple cider fragrance FR green apple fragrance FR baked apple fragrance FR red apple fragrance FR apple ketal FL/FR apple specialty FR benzyl isovalerate FL/FR benzyl propionate FL/FR iso butyl isovalerate FL/FR butyl isovalerate FL/FR cyclohexyl butyrate FL/FR cyclohexyl isovalerate FL/FR (E)-alpha- damascone FL/FR eriocephalus punctulatus flower oil FR ethyl 2-methyl butyrate FL/FR ethyl 3-methyl valerate FL/FR ethyl isobutyrate FL/FR ethyl isovalerate FL/FR ethyl valerate FL/FR fruity ketal FL/FR geranyl 2-methyl butyrate FL/FR geranyl isovalerate FL/FR heptanal cyclic ethylene acetal FR (Z)-3- hexen-1-yl isobutyrate FL/FR hexyl formate FL/FR hexyl isovalerate FL/FR methyl acetoacetate FL/FR 2- methyl butyl butyrate FL/FR methyl butyrate FL/FR methyl isovalerate FL/FR methyl valerate FL/FR propyl 2-methyl butyrate FL/FR propyl heptanoate FL/FR iso propyl isobutyrate FL/FR iso propyl isovalerate FL/FR propyl isovalerate FL/FR (E,E)-5,6,7,7- tetramethyl-2,5-octadien-4-one FR (E)-2- undecenal FL/FR green butyl heptanoate FL/FR citrus carbaldehyde / methyl anthranilate schiff's base FR ethyl (E,Z)-2,4-decadienoate FL/FR galbascone (IFF) FR green carboxylate FR green note propionate FL/FR (Z)-3- hexen-1-yl 2-methyl butyrate FL/FR (Z)-3- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl butyrate FL/FR (E)-2- hexen-1-yl butyrate FL/FR (E)-2- hexen-1-yl propionate FL/FR (E)-2- hexen-1-yl valerate FL/FR (Z)-3- hexen-1-yl valerate FL/FR (Z)-3- hexenal FL/FR (Z)-3- hexenal diethyl acetal FL/FR (E)-2- hexenal propylene glycol acetal FL/FR 3- hexenyl 2-methyl butyrate FL/FR hexyl 2-methyl butyrate FL/FR hexyl butyrate FL/FR hexyl isobutyrate FL/FR methyl (E)-3-hexenoate FL/FR 3- octyl formate FL/FR (E)-2- pentenal FL/FR pineapple heptadienone 10% FR propyl tiglate FL/FR herbal (1S,5R)- myrtenyl acetate FL/FR musty hazelnut pyrazine FL/FR nutty 2- acetyl-3,5-dimethyl pyrazine FL/FR 2- acetyl-3,5(or 6)-dimethyl pyrazine FL/FR 2- methyl-3-ethoxypyrazine FL/FR 2- methyl-3-pentenoic acid FL/FR popcorn 2- acetyl pyrazine FL/FR 2- acetyl thiazole FL/FR powdery applelide (IFF) FR sulfurous ethyl methyl mercaptopropionate FL/FR waxy 3- decanone FL/FR ethyl decanoate FL/FR woody marine formate FR lariciu pine needle oil FR For Flavor No flavor group found for these acetaldehyde hexyl isoamyl acetal FL/FR amyl 2-methyl butyrate FL/FR amyl isobutyrate FL/FR amyl isovalerate FL/FR 2-iso butyl-3,5-(and 3,6)-dimethyl pyrazine FL/FR butyrophenone FL/FR beta- cubebene FL cyclohexyl butyrate FL/FR (Z)-alpha- damascone FL/FR 3- decanone FL/FR dihydronootkatone FL 4,5- dimethyl-2-ethyl thiazole FL (Z)-4- dodecenal FL/FR ethyl 3-methyl valerate FL/FR geranyl 2-methyl butyrate FL/FR heptyl 2-methyl butyrate FL hexanal diethyl acetal FL/FR (E)-3- hexenal FL (Z)-3- hexenal diethyl acetal FL/FR (E)-2- hexenal dimethyl acetal FL (E)-2- hexenal propylene glycol acetal FL/FR 2- hexyl acetate FL methyl acetoacetate FL/FR 2- methyl-3-ethoxypyrazine FL/FR 2- methyl-3-pentenoic acid FL/FR propyl 2-methyl butyrate FL/FR iso propyl isobutyrate FL/FR propyl isovalerate FL/FR iso propyl isovalerate FL/FR propyl tiglate FL/FR (Z)-8- tetradecenal FL/FR alliaceous alliaceous allyl propionate FL/FR citrus dehydronootkatone FL corn chip 2- acetyl thiazole FL/FR ethereal ethyl isobutyrate FL/FR fatty 2- dodecanone FL/FR floral citronellyl acetate FL/FR methyl citronellate FL/FR fruity allyl heptanoate FL/FR iso amyl 2-methyl butyrate FL/FR iso amyl valerate FL/FR apple ketal FL/FR benzyl isovalerate FL/FR benzyl propionate FL/FR butyl heptanoate FL/FR butyl isovalerate FL/FR cyclohexyl isovalerate FL/FR (E)-alpha- damascone FL/FR alpha- damascone FL/FR ethyl 2-methyl butyrate FL/FR ethyl isovalerate FL/FR ethyl valerate FL/FR fruity ketal FL/FR (Z)-3- hexen-1-yl isobutyrate FL/FR 2- methyl butyl butyrate FL/FR methyl isovalerate FL/FR methyl valerate FL/FR neryl isovalerate FL/FR terpinyl formate FL/FR fusel methyl butyrate FL/FR green iso butyl isovalerate FL/FR 3- decen-2-one FL/FR ethyl (E,Z)-2,4-decadienoate FL/FR geranyl isovalerate FL/FR green note propionate FL/FR (Z)-3- hexen-1-yl 2-methyl butyrate FL/FR (Z)-3- hexen-1-yl acetate FL/FR (E)-2- hexen-1-yl butyrate FL/FR (Z)-3- hexen-1-yl butyrate FL/FR (E)-2- hexen-1-yl propionate FL/FR (E)-2- hexen-1-yl valerate FL/FR (Z)-3- hexen-1-yl valerate FL/FR (Z)-3- hexenal FL/FR 3- hexenyl 2-methyl butyrate FL/FR hexyl 2-methyl butyrate FL/FR hexyl butyrate FL/FR hexyl formate FL/FR hexyl isobutyrate FL/FR hexyl isovalerate FL/FR methyl (E)-3-hexenoate FL/FR (E)-2- pentenal FL/FR musty hazelnut pyrazine FL/FR nutty 2- acetyl-3,5-dimethyl pyrazine FL/FR 2- acetyl-3,5(or 6)-dimethyl pyrazine FL/FR 2,5- diethyl-3-methyl pyrazine FL european hazelnut oleoresin FL 2- methoxy-3-methyl pyrazine FL/FR 2,4,5- trimethyl thiazole FL/FR roasted 2- acetyl pyrazine FL/FR sulfurous ethyl methyl mercaptopropionate FL/FR waxy ethyl decanoate FL/FR 3- octyl formate FL/FR propyl heptanoate FL/FR (E)-2- undecenal FL/FR woody (1S,5R)- myrtenyl acetate FL/FR   Potential Uses: FR apple FR autumn FR fruit FR hazelnut FL tropical   Occurrence (nature, food, other):note   not found in nature   Synonyms:   butanoic acid, 3-methyl-, nonyl ester 3- methyl butanoic acid nonyl ester   nonyl 3-methyl butanoate   nonyl 3-methylbutanoate   nonyl isopentanoate   nonyl isovalerianate iso valeric acid nonyl ester iso valeric acid, nonyl ester   Articles:   None found yet. 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Notes: Flavouring ingredient