isobornyl isovalerate
DL-isobornyl isovalerate

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  977 ISOBORNYL ISOVALERATE ≥97.0%, Kosher
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  For a fruity, minty lift in fragrances. Used mostly for oral hygiene products such as mouthwash and toothpaste flavors.

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  7779-73-9 isoBORNYL ISOVALERATE 97.0%

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  A0683 isoBornyl Isovalerate

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  W01770 isoBornyl Isovalerate

Name: [(1S,6R)-1,7,7-trimethyl-6-bicyclo[2.2.1]heptanyl] 3-methylbutanoate CAS Number: 7779-73-9 3D/inchi Other(deleted CASRN): 116963-99-6 ECHA EINECS - REACH Pre-Reg: 231-935-4 FDA UNII: X58D56297G Nikkaji Web: J74.696G CoE Number: 452 XlogP3: 4.60 (est) Molecular Weight: 238.37062000 Formula: C15 H26 O2 NMR Predictor: Predict (works with chrome, Edge or firefox) EFSA/JECFA Comments: Racemate (±) = DL-Isobornyl isovalerate. CASrn in Register refers to (1R,2R,4R)-rel. Register name to be changed to DL-Isobornyl isovalerate (EFFA, 2011m). 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: 1394 isobornyl isovalerate DG SANTE Food Flavourings: 09.457 isobornyl isovalerate FEMA Number: 2166 isobornyl isovalerate FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 7779-73-9 ; ISOBORNYL 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 to pale yellow clear liquid (est) Assay: 96.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.94300 to 0.95500 @ 25.00 °C. Pounds per Gallon - (est).: 7.847 to 7.947 Refractive Index: 1.45800 to 1.46400 @ 20.00 °C. Boiling Point: 151.00 to 152.00 °C. @ 26.00 mm Hg Boiling Point: 266.00 to 269.00 °C. @ 760.00 mm Hg Acid Value: 1.00 max. KOH/g Vapor Pressure: 0.120000 mmHg @ 25.00 °C. Flash Point: 230.00 °F. TCC ( 110.00 °C. ) logP (o/w): 4.889 (est) Soluble in:   alcohol   water, 0.8885 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 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 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: woody Odor Strength:medium Substantivity: > 168 hour(s) at 100.00 % woody dry valerian root pine camphoreous oily balsamic forest Odor Description:at 100.00 %. woody dry valerian root pine camphoreous oily balsamic forest Luebke, William tgsc, (2021) Odor sample from: Bedoukian Research, Inc. woody cooling pine oily green Odor Description:Woody, mild, cooling and borneol-like with oily and green nuances Mosciano, Gerard P&F 22, No. 3, 47, (1997) Flavor Type: woody woody dry oily balsamic camphoreous pine woody oak wood spruce Taste Description: woody dry oily balsamic camphoreous pine oak wood spruce woody camphoreous pine green Taste Description: Woody, camphoreous and borneol-like with green nuances Mosciano, Gerard P&F 22, No. 3, 47, (1997) Odor and/or flavor descriptions from others (if found). Bedoukian Research ISOBORNYL ISOVALERATE ≥97.0%, Kosher Odor Description:A subtle mint, berry note For a fruity, minty lift in fragrances. Taste Description:minty Used mostly for oral hygiene products such as mouthwash and toothpaste flavors.   Cosmetic Information: CosIng: cosmetic data Cosmetic Uses: perfuming agents   Suppliers: Apple Flavor & Fragrance Isobornyl isovalerate Bedoukian Research ISOBORNYL ISOVALERATE sds ≥97.0%, Kosher Odor: A subtle mint, berry note Use: For a fruity, minty lift in fragrances. Flavor: minty Used mostly for oral hygiene products such as mouthwash and toothpaste flavors. BOC Sciences For experimental / research use only. isoBORNYL ISOVALERATE 97.0% Lluch Essence ISOBORNYL ISOVALERATE M&U International isoBornyl Isovalerate Parchem isoBornyl Isovalerate Penta International ISOBORNYL ISOVALERATE Shanghai Vigen Fine Chemical isoBornyl Isovalerate Synerzine isoBornyl Isovalerate   Safety Information: Preferred SDS: View 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. Human Experience: 4% produced no irritation or sensitization. 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 isobornyl isovalerate usage levels up to:   10.0000 % in the fragrance concentrate.   Maximised Survey-derived Daily Intakes (MSDI-EU): 0.012 (μg/capita/day) Maximised Survey-derived Daily Intakes (MSDI-USA): 0.08 (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: 3 Click here to view publication 3   average usual ppm average maximum ppm baked goods: 0.80000 2.00000 beverages(nonalcoholic): 0.60000 11.00000 beverages(alcoholic): - - breakfast cereal: - - cheese: - - chewing gum: - - condiments / relishes: - - confectionery froastings: - - egg products: - - fats / oils: - - fish products: - - frozen dairy: 0.30000 1.00000 fruit ices: 0.30000 1.00000 gelatins / puddings: - - granulated sugar: - - gravies: - - hard candy: - 0.90000 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 47, (FGE.47)[1] - Bicyclic secondary alcohols, ketones and related esters from chemical group 8 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf Flavouring Group Evaluation 87, (FGE.87)[1] - Consideration of bicyclic secondary alcohols, ketones and related esters evaluated by JECFA (63rd meeting) structurally related to bicyclic secondary alcohols, ketones and related esters evaluated by EFSA in FGE.47 (2008) - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf Scientific Opinion on Flavouring Group Evaluation 87 Revision 1 (FGE.87Rev1): Consideration of bicyclic secondary alcohols, ketones and related esters evaluated by JECFA (63rd meeting) structurally related to bicyclic secondary alcohols, ketones and related esters evaluated by EFSA in FGE.47 (2008) View page or View pdf Scientific Opinion on Flavouring Group Evaluation 87, Revision 2 (FGE.87Rev2): Consideration of bicyclic secondary alcohols, ketones and related esters evaluated by JECFA (63rd meeting) structurally related to bicyclic secondary alcohols, ketones and related esters evaluated by EFSA in FGE.47Rev1 (2008) View page or View pdf EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):7779-73-9 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :60968 National Institute of Allergy and Infectious Diseases:Data WGK Germany:1 [(1S,6R)-1,7,7-trimethyl-6-bicyclo[2.2.1]heptanyl] 3-methylbutanoate Chemidplus:0007779739   References:   [(1S,6R)-1,7,7-trimethyl-6-bicyclo[2.2.1]heptanyl] 3-methylbutanoate NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 7779-73-9 Pubchem (cid): 60968 Pubchem (sid): 135262959   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): HMDB38250 FooDB: FDB017543 Export Tariff Code: 2916.20.5000 Typical G.C. VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note For Odor balsamic betula pubescens bud oil FL/FR laevo- borneol FL/FR dextro,laevo- borneol FL/FR laevo- bornyl acetate FL/FR bornyl acetate FL/FR iso bornyl acetate FL/FR iso bornyl isobutyrate FL/FR iso bornyl methyl ether FL/FR iso bornyl propionate FL/FR fir balsam absolute FR gurjun balsam FR spruce needle absolute FL/FR citrus ocimene quintoxide FL/FR floral karo karounde absolute FR linalool FL/FR beta- ocimene FL/FR fruity green acetate FR herbal 1- allyl-2,2,7,7-tetramethyl cycloheptanol FR (-)- bornyl isovalerate FL/FR iso dihydrolavandulal FL/FR geranic oxide FL/FR hop absolute FL/FR 6- hydroxydihydrotheaspirane (mixture of isomers) FL/FR methyl cyclogeranate (Firmenich) FR myrtenol FL/FR nonisyl formate FR nopyl acetate FR 3- octyl acetate FL/FR laevo-beta- pinene FL/FR pinocarveol FL/FR sabinene hydrate FL/FR terpinolene FL/FR mentholic peppermint cyclohexanone FL/FR minty dextro- dihydrocarvone FL/FR (-)-iso pulegol FL/FR spicy carvacrol FL/FR beta- caryophyllene FL/FR caryophyllene FL/FR terpenic pine needle oil dwarf FL/FR thujonic cedarleaf oil terpeneless FR woody 2-tert- butyl cyclohexanone FR para-tert- butyl cyclohexanone FR cedarwood oil port orford FR (E+Z)-4,8- dimethyl-3,7-nonadien-2-ol FL/FR hinoki root oil FR myrtenyl formate FL/FR nopyl aldehyde FR cis-2- pinanol FR spikenard oil FL/FR For Flavor No flavor group found for these betula pubescens bud oil FL/FR dextro,laevo- borneol FL/FR (-)- bornyl isovalerate FL/FR iso bornyl methyl ether FL/FR (E+Z)-4,8- dimethyl-3,7-nonadien-2-ol FL/FR myrtenyl formate FL/FR laevo-beta- pinene FL/FR spikenard oil FL/FR balsamic balsamic laevo- bornyl acetate FL/FR iso bornyl isobutyrate FL/FR iso bornyl propionate FL/FR spruce needle absolute FL/FR camphoreous laevo- borneol FL/FR bornyl acetate FL/FR geranic oxide FL/FR 6- hydroxydihydrotheaspirane (mixture of isomers) FL/FR pinocarveol FL/FR citrus linalool FL/FR cooling sabinene hydrate FL/FR green dextro- dihydrocarvone FL/FR beta- ocimene FL/FR ocimene quintoxide FL/FR 3- octyl acetate FL/FR herbal iso dihydrolavandulal FL/FR hop absolute FL/FR mentholic peppermint cyclohexanone FL/FR minty (1R)-(-)- myrtenal FL myrtenol FL/FR (-)-iso pulegol FL/FR pine pine needle oil dwarf FL/FR spicy carvacrol FL/FR caryophyllene FL/FR beta- caryophyllene FL/FR galanga flavor FL white pepper oleoresin FL woody iso bornyl acetate FL/FR terpinolene FL/FR   Potential Uses: FR berry   disinfectants FR fir needle oil replacer FR herbal FR lavender FR pineapple FR raspberry FL/FR valerian FR violet leaf   Occurrence (nature, food, other):note   achillea biebersteinu Search Trop Picture   achillea tenuifolia Search Trop Picture   duran Search Trop Picture   eclipta prostrata Search Trop Picture   lavender oil spike spain @ 0.17% Data GC Search Trop Picture   pinus mugo Search Trop Picture   tanacetum macrophyllum Search Trop Picture   valerian root oil Search Trop Picture   valeriana sisymbriifolia Search Trop Picture   Synonyms: iso bornyl 3-mehtyl butanoate   bornyl 3-methylbutanoate iso bornyl 3-methylbutanoate iso bornyl isopentanoate DL-iso bornyl isovalerate exo- bornyl isovalerate iso bornyl isovalerianate iso bornyval   butanoic acid, 3-methyl-, 1,7,7-trimethylbicyclo(2.2.1)hept-2-yl ester, endo-   butanoic acid, 3-methyl-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-   hysterol 3- methyl butanoic acid (1R,2R,4R)-rel-1,7,7-trimethyl bicyclo(2.2.1)hept-2-yl ester exo-3- methyl butanoic acid 7,7-trimethylbicyclo(2.2.1)hept-2-yl ester exo-1,7,7- trimethyl bicyclo(2.2.1)hept-2-yl 3-methyl butanoate (1,7,7- trimethyl-6-bicyclo[2.2.1]heptanyl) 3-methylbutanoate [(1S,6R)-1,7,7- trimethyl-6-bicyclo[2.2.1]heptanyl] 3-methylbutanoate 1,7,7- trimethyl-bicyclo(2.2.1)hept-2-yl 3-methylbutanoate 1,7,7- trimethylbicyclo(2.2.1)hept-2-yl 3-methylbutanoate 1,7,7- trimethylbicyclo[2.2.1]hept-2-yl 3-methylbutanoate iso valeric acid isobornyl ester iso valeric acid, 2-bornyl ester   Articles:   None found yet. 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Notes: Accentuate warm herbal notes. Flavouring agent