bornane-3,1-cyclopenta-2-one
bornane-3,1-cyclopenta-2-one

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Name: 4,7,7-trimethylspiro[bicyclo[2.2.1]heptane-2,1'-cyclopentane]-3-one CAS Number: 107715-18-4 3D/inchi FDA UNII: Search Nikkaji Web: J111.307K XlogP3-AA: 3.60 (est) Molecular Weight: 206.32854000 Formula: C14 H22 O NMR Predictor: Predict (works with chrome, Edge or firefox) Category: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   Physical Properties: Appearance: colorless clear liquid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.99500 to 1.00500 @ 20.00 °C. Pounds per Gallon - (est).: 8.289 to 8.372 Refractive Index: 1.49100 to 1.50100 @ 20.00 °C. Boiling Point: 197.00 to 198.00 °C. @ 11.00 mm Hg Vapor Pressure: 0.012000 mmHg @ 25.00 °C. Flash Point: 176.00 °F. TCC ( 80.00 °C. ) Soluble in:   water, 3.325 mg/L @ 25 °C (est) Stability:   ph from 4 - 11   Organoleptic Properties: Odor Type: herbal Odor Strength:medium Substantivity:88 hour(s) at 100.00 % herbal sage clary sage woody vetiver Odor Description:at 100.00 %. new car woody clary vetiver Luebke, William tgsc, (1991) Odor sample from: Kao Corporation Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers:   None found   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: oral-rat LD50 44300 mg/kg Kao Corporation Dermal Toxicity: Not determined Inhalation Toxicity: Not determined   Safety in Use Information: Category: 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 bornane-3,1-cyclopenta-2-one usage levels up to:   5.0000 % in the fragrance concentrate.   Recommendation for bornane-3,1-cyclopenta-2-one flavor usage levels up to:   not for flavor use.   Safety References: EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):107715-18-4 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :14818318 National Institute of Allergy and Infectious Diseases:Data 4,7,7-trimethylspiro[bicyclo[2.2.1]heptane-2,1'-cyclopentane]-3-one Chemidplus:0107715184   References:   4,7,7-trimethylspiro[bicyclo[2.2.1]heptane-2,1'-cyclopentane]-3-one NIST Chemistry WebBook: Search Inchi Pubchem (cid): 14818318 Pubchem (sid): 135304250   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   Potential Blenders and core components note For Odor amber acetoxymethyl isolongifolene FR amber spirolene FR formoxymethyl isolongifolene FR animal iso butyl quinoline FR balsamic dextro,laevo-iso borneol FL/FR iso bornyl acetate FL/FR brachyleana hutchinsii wood oil FR guaiacyl phenyl acetate FL/FR camphoreous dextro- camphor FL/FR citrus grapefruit indene FR grapefruit nitrile FR grapefruit pentanol FR earthy 2- octanone FL/FR patchouli cyclohexanol FR floral iso amyl salicylate FL/FR anise indene FR cassis oxime 10% FR gardenia decalone FR alpha- ionol FL/FR alpha- ionyl acetate FR (Z)- jasmone FL/FR karo karounde absolute FR lavender oil france FL/FR lavender oil greece FL/FR methyl ionyl acetate FL/FR nonisyl propionate FR petitgrain bigarade oil FL/FR phenyl glycol diacetate FR prenyl salicylate FL/FR vetiver pentanone FR fruity benzyl heptanoate FL/FR 3- benzyl-4-heptanone FL/FR green bergoxane FR iso cyclocitral (IFF) FL/FR heptyl benzoate FL/FR magnolia flower oil FL/FR para- methyl hydratropaldehyde FL/FR herbal bergamot mint herb oil FR bornyl 2-methyl butyrate FL/FR bornyl butyrate FL/FR beta- bourbonene FL/FR alpha- cadinol FL/FR clary propyl acetate FR clary sage oil france FL/FR clary sage resin america FR coriander oleoresin FL/FR costmary oil (chrysanthemum balsamita) FR dimethyl cyclormol (IFF) FR 2,10- epoxypinane FR herbal carene FR herbal undecanone FR hyssop oil FL/FR immortelle flower oil FL/FR linalyl isovalerate FL/FR 2- methyl butyl salicylate FL/FR 1,3- oxathiane, 2-ethyl-4,4-dimethyl- FR curled parsley leaf oil FL/FR sage absolute spain FL/FR tea leaf absolute FL/FR thyme oil wild or creeping FL/FR tricyclodecenyl propionate FR minty pennyroyal oil FL/FR spicy cinnamon acrolein FL/FR black currant bud absolute FL/FR 4-iso propyl-2-cyclohexenone FL/FR thujonic armoise oil FR sage oil (salvia lavandulifolia vahl.) spain FL/FR sage oil dalmatian FL/FR sage oil england FL/FR sage oil france FL/FR sage oil germany FL/FR sage oil hydrodistillation france FL/FR sage oil reunion FL/FR sage oil sardinia FL/FR sage oil spain (salvia officinalis) FL/FR woody ketone FL/FR woody agarwood oil replacer FR amyris acetate FR iso butyl ionone FR camphene FL/FR (+)- camphene FL/FR cedar cyclododecatriene FR cedarwood oil terpenes FL/FR cedryl formate FR cistus twig/leaf oil FL/FR guaiacwood extract acetate FR herbal norbornane FR marine formate FR methyl cedryl ketone FL/FR alpha-iso methyl ionol FR iso methyl tetrahydroionyl acetate FR polylimonene FL/FR spruce needle oil canada FL/FR vetiveryl acetate FL/FR vetylbois FR zdravetz absolute FR zdravetz oil FL/FR For Flavor No flavor group found for these benzyl heptanoate FL/FR bornyl 2-methyl butyrate FL/FR bornyl butyrate FL/FR beta- bourbonene FL/FR alpha- cadinol FL/FR (+)- camphene FL/FR heptyl benzoate FL/FR magnolia flower oil FL/FR 2- methyl butyl salicylate FL/FR polylimonene FL/FR 4-iso propyl-2-cyclohexenone FL/FR vetiveryl acetate FL/FR woody ketone FL/FR zdravetz oil FL/FR camphoreous camphoreous dextro,laevo-iso borneol FL/FR camphene FL/FR citrus petitgrain bigarade oil FL/FR dairy 2- octanone FL/FR fruity 3- benzyl-4-heptanone FL/FR linalyl isovalerate FL/FR green iso amyl salicylate FL/FR iso cyclocitral (IFF) FL/FR para- methyl hydratropaldehyde FL/FR herbal clary sage oil france FL/FR coriander oleoresin FL/FR hyssop oil FL/FR immortelle flower oil FL/FR lavender oil france FL/FR lavender oil greece FL/FR curled parsley leaf oil FL/FR prenyl salicylate FL/FR sage absolute spain FL/FR sage oil (salvia lavandulifolia vahl.) spain FL/FR thyme oil wild or creeping FL/FR medicinal dextro- camphor FL/FR minty pennyroyal oil FL/FR phenolic guaiacyl phenyl acetate FL/FR spicy cinnamon acrolein FL/FR black currant bud absolute FL/FR tea tea leaf absolute FL/FR thujonic sage oil dalmatian FL/FR sage oil england FL/FR sage oil france FL/FR sage oil germany FL/FR sage oil hydrodistillation france FL/FR sage oil reunion FL/FR sage oil sardinia FL/FR sage oil spain (salvia officinalis) FL/FR woody iso bornyl acetate FL/FR cedarwood oil terpenes FL/FR cistus twig/leaf oil FL/FR alpha- ionol FL/FR (Z)- jasmone FL/FR methyl cedryl ketone FL/FR methyl ionyl acetate FL/FR spruce needle oil canada FL/FR   Potential Uses: FR clary sage oil replacer FR herbal FR moss FR new car FR vetiver FR woody   Occurrence (nature, food, other):note   not found in nature   Synonyms:   sagetone V 4,7,7- trimethyl-spiro[bicyclo[2.2.1]heptane-2,1'-cyclopentan]-3-one 4,7,7- trimethylspiro[bicyclo[2.2.1]heptane-2,1'-cyclopentane]-3-one   Articles:   None found yet. 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Notes: None found

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