guaiyl butyrate
(3S-(3a,5a,8a))-1-methyl-1-(1,2,3,4,5,6,7,8-octahydro-3,8-dimethylazulen-5-yl)ethyl butyrate

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Name: 2-[(3S,5R,8S)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-yl butanoate CAS Number: 73003-91-5 3D/inchi ECHA EINECS - REACH Pre-Reg: 277-213-2 FDA UNII: BXX9GGI596 Nikkaji Web: J195.365F XlogP3-AA: 4.50 (est) Molecular Weight: 292.46244000 Formula: C19 H32 O2 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 to pale yellow clear liquid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.99000 @ 25.00 °C. Refractive Index: 1.49500 @ 25.00 °C. Boiling Point: 315.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.000016 mmHg @ 25.00 °C. (est) Flash Point: 219.00 °F. TCC ( 103.89 °C. ) logP (o/w): 6.793 (est) Soluble in:   alcohol   water, 0.009096 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: balsamic rose plum animal balsamic woody Odor Description:at 100.00 %. rose plum animal balsamic woody Flavor Type: fruity plum fruity Taste Description: plum 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: Not determined 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 guaiyl butyrate usage levels up to:   8.0000 % in the fragrance concentrate.   Recommendation for guaiyl butyrate 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):73003-91-5 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :175381 National Institute of Allergy and Infectious Diseases:Data 2-[(3S,5R,8S)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-yl butanoate Chemidplus:0073003915   References:   2-[(3S,5R,8S)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-yl butanoate NIST Chemistry WebBook: Search Inchi Pubchem (cid): 175381 Pubchem (sid): 135153369   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 Export Tariff Code: 2915.60.0000 ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these eremophila mitchelli wood oil australia FR (E)- sabinene hydrate FL/FR aldehydic aldehydic nonanal diethyl acetal FL/FR anisic para- anisyl phenyl acetate FL/FR balsamic ambrene specialty FR amyris wood oil FL/FR amyris wood oil replacer FR balsam fir oleoresin FL/FR siam benzoin absolute FL/FR siam benzoin resin FL/FR siam benzoin resinoid FL/FR benzoin resinoid replacer FR 1- benzoyl acetone FL/FR laevo- bornyl acetate FL/FR brachyleana hutchinsii wood oil FR callitropsis araucarioides wood oil FR cistus leaf oil FR conifer acetate FR copaifera reticulata extract FL/FR croton glabellus bark extract FL/FR ethyl cinnamate FL/FR fir balsam absolute (abies balsamea) FR fir needle oil canada FL/FR fir needle oil terpeneless canada FL/FR gurjun balsam FR hemlock western oil (tsuga heterophylla) canada FR juniper absolute FL/FR juniper berry absolute FL/FR juniper berry oil CO2 extract FL/FR methyl hydrogenated rosinate FR myrrh absolute FL/FR myrrh gum FL/FR myrrh resin FL/FR myrrh resinoid FR myrrh resinoid replacer FR opoponax absolute (commiphora erythraea var. glabrescens engle) FL/FR opoponax absolute replacer FR opoponax resinoid (commiphora erythraea var. glabrescens engle) FR opoponax resinoid replacer FR peru balsam absolute FL/FR scotch pine wood/needles resinoid FR pistacia lentiscus gum water FR styrax speciality FR tolu balsam absolute FL/FR tolu balsam resin FL/FR tolu balsam resinoid FL/FR valeriana wallichii root oil FR fir needle abies amabilis oil canada FR floral iso amyl undecylenate FL/FR para- anisyl butyrate FL/FR benzyl alcohol FL/FR butyl benzyl ether FL/FR cananga oil FL/FR cananga oil china FL/FR citronellyl formate FL/FR citronellyl propionate FL/FR beta- damascenone FL/FR gamma- damascone FR (Z)-alpha- damascone FL/FR (Z)-4- decen-1-yl acetate FL/FR dihydrocarvyl acetate FL/FR dimethyl anthranilate FL/FR dimethyl benzyl carbinyl butyrate FL/FR eucalyptus macarthurii oil FR farnesyl acetate FL/FR floral pyran FR gardenia pentyl acetate FR geranium rose-scented oil cuba FR geranyl acetate FL/FR (E)- geranyl linalool FL/FR hawthorn ethanol FR beta- ionol FL/FR 2- methyl octanal FL/FR musk acetate FR neryl acetate FL/FR neryl isovalerate FL/FR nonanol FL/FR petitgrain mandarin oil FL/FR phenethyl acetate FL/FR phenethyl anthranilate FL/FR phenethyl phenyl acetate FL/FR phenethyl salicylate FL/FR phenyl acetaldehyde digeranyl acetal FR 1- phenyl propyl butyrate FL/FR plum damascone FR propyl salicylate FR rose absolute (rosa centifolia) morocco FL/FR rose butanoate FL/FR laevo- rose oxide FL/FR styralyl propionate FL/FR (E)-2- undecen-1-ol FL/FR 2- undecen-1-ol FL/FR fruity apple crotonate FR apricot isobutyrate FR 3- benzyl-4-heptanone FL/FR butyl anthranilate FL/FR butyl formate FL/FR beta- damascone FL/FR (E)-alpha- damascone FL/FR (Z)-beta- damascone FL/FR (E)-beta- damascone FL/FR alpha,alpha- dimethyl benzyl isobutyrate FL/FR ethyl 4-phenyl butyrate FL/FR fruity butanate FR hexyl formate FL/FR 3- phenyl propyl isovalerate FL/FR plum crotonate FR plum damascone (high alpha) FR strawberry glycidate 2 FL/FR styralyl butyrate FL/FR 4-(para- tolyl)-2-butanone FL/FR green iso amyl formate FL/FR holy basil leaf oil FL/FR iso decanal FL/FR galbanum absolute FL/FR galbanum oil FL/FR galbanum oil replacer FR galbanum oleoresin FL/FR galbanum resinoid FL/FR heptyl formate FL/FR phenyl acetaldehyde FL/FR valerian rhizome oil CO2 extract china FL/FR herbal artemisia vestita wall. leaf oil FR calendula officinalis flower oil CO2 extract FR camphor wood oil decamphorised FR cananga fruit oil FR canarium luzonicum gum FL/FR chamomile absolute FL/FR elemi resinoid replacer FR lavender oil australia FL/FR marigold pot flower oil FL/FR rosemary absolute FL/FR rosemary oil FL/FR rosemary oil africa FL/FR rosemary oil morocco FL/FR rosemary oil replacer FR rosemary oil spain FL/FR rosemary oil tunisia FL/FR green tea leaf absolute FL/FR valerian rhizome oil FL/FR valerian rhizome oil china FL/FR honey elder flower oil FR nutty sesame absolute FL/FR sesame absolute CO2 extract FL/FR pine abies sibirica needle extract FR white pine bark oil FL/FR pine specialty FR powdery para- anisyl acetate FL/FR smoky boswellia serrata wood tar oil FR spicy cananga leaf oil FR cardamom oil replacer FR cinnamomum culilawan bark oil FR clove bud oil FL/FR clove bud oil replacer FR clove leaf oil FL/FR elettaria cardamomum seed oil FL/FR elettaria cardamomum seed oil guatemala FL/FR myristica fragrans fruit extract FL/FR myristica fragrans seed tincture FL/FR nutmeg absolute FL/FR terpenic elemi resinoid FL/FR pine needle oil dwarf FL/FR turpentine oil FL/FR tonka tonka undecanone FR woody agarwood oil FR agarwood oil CO2 extract FR agarwood oil replacer FR agarwood specialty FR bulnesia sarmienti extract FR callitris columellaris wood oil australia FR cedanol FR cedarwood acetate FR cedarwood oil texas fractions FR cistus twig/leaf absolute FR copaiba balsam FL/FR eremophila mitchelli wood oil CO2 extract FR guaiacwood oil 20% in gurjun balsam oil FR alpha- guaiene FL/FR gurjun balsam oil FR alpha- gurjunene FR 4- hydroxybenzaldehyde FL/FR kaempferia galanga rhizome oil FL/FR patchouli oil FL/FR sandal cyclohexanol FR sandal hexanol FR (R)- sandal hexanol FR sandalwood oil FL/FR sandalwood oil CO2 extract FL/FR sandalwood oil replacer FR sandalwood oil west australia FL/FR sandalwood oil west australia (santalum spicatum) FR santall FR santalum paniculatum wood oil FR santalyl butyrate FL/FR siam wood oil FR vetiver oil bourbon FL/FR vetiver oil brazil FL/FR vetiver oil china FL/FR vetiver oil india FL/FR vetiverol FL/FR (Z)- woody amylene FR For Flavor No flavor group found for these iso amyl undecylenate FL/FR balsam fir oleoresin FL/FR holy basil leaf oil FL/FR 1- benzoyl acetone FL/FR butyl benzyl ether FL/FR butyl formate FL/FR croton glabellus bark extract FL/FR (Z)-alpha- damascone FL/FR iso decanal FL/FR (Z)-4- decen-1-yl acetate FL/FR ethyl 4-phenyl butyrate FL/FR fir needle oil canada FL/FR (E)- geranyl linalool FL/FR alpha- guaiene FL/FR 2- hexenal FL juniper absolute FL/FR marigold pot flower oil FL/FR 2- methyl octanal FL/FR nonanal diethyl acetal FL/FR 1- phenyl propyl butyrate FL/FR 3- phenyl propyl isovalerate FL/FR white pine bark oil FL/FR (E)- sabinene hydrate FL/FR sandalwood oil west australia FL/FR santalyl butyrate FL/FR turpentine oil FL/FR 2- undecen-1-ol FL/FR (E)-2- undecen-1-ol FL/FR beta- damascone FL/FR anisic anisic para- anisyl butyrate FL/FR para- anisyl phenyl acetate FL/FR balsamic siam benzoin resin FL/FR siam benzoin resinoid FL/FR laevo- bornyl acetate FL/FR copaifera reticulata extract FL/FR ethyl cinnamate FL/FR fir needle oil terpeneless canada FL/FR juniper berry absolute FL/FR juniper berry oil CO2 extract FL/FR myrrh absolute FL/FR myrrh gum FL/FR myrrh resin FL/FR opoponax absolute (commiphora erythraea var. glabrescens engle) FL/FR peru balsam absolute FL/FR tolu balsam absolute FL/FR tolu balsam resin FL/FR tolu balsam resinoid FL/FR camphoreous kaempferia galanga rhizome oil FL/FR rosemary oil tunisia FL/FR citrus petitgrain mandarin oil FL/FR styralyl propionate FL/FR creamy 4- hydroxybenzaldehyde FL/FR fatty heptyl formate FL/FR floral cananga oil FL/FR cananga oil china FL/FR citronellyl propionate FL/FR dihydrocarvyl acetate FL/FR dimethyl benzyl carbinyl butyrate FL/FR farnesyl acetate FL/FR beta- ionol FL/FR neryl acetate FL/FR phenethyl anthranilate FL/FR rose absolute (rosa centifolia) morocco FL/FR laevo- rose oxide FL/FR fruity para- anisyl acetate FL/FR benzyl alcohol FL/FR 3- benzyl-4-heptanone FL/FR butyl anthranilate FL/FR citronellyl formate FL/FR (E)-beta- damascone FL/FR (E)-alpha- damascone FL/FR (Z)-beta- damascone FL/FR dimethyl anthranilate FL/FR alpha,alpha- dimethyl benzyl isobutyrate FL/FR methyl formate FL neryl isovalerate FL/FR rose butanoate FL/FR strawberry glycidate 2 FL/FR styralyl butyrate FL/FR 4-(para- tolyl)-2-butanone FL/FR valerian rhizome oil FL/FR valerian rhizome oil china FL/FR valerian rhizome oil CO2 extract china FL/FR green iso amyl formate FL/FR canarium luzonicum gum FL/FR elemi resinoid FL/FR galbanum absolute FL/FR galbanum oil FL/FR galbanum oleoresin FL/FR galbanum resinoid FL/FR geranyl acetate FL/FR hexyl formate FL/FR herbal chamomile absolute FL/FR lavender oil australia FL/FR rosemary absolute FL/FR rosemary oil FL/FR rosemary oil africa FL/FR rosemary oil morocco FL/FR rosemary oil spain FL/FR honey phenethyl acetate FL/FR phenethyl phenyl acetate FL/FR phenyl acetaldehyde FL/FR medicinal, phenethyl salicylate FL/FR nutty sesame absolute FL/FR sesame absolute CO2 extract FL/FR pine pine needle oil dwarf FL/FR spicy siam benzoin absolute FL/FR clove bud oil FL/FR clove leaf oil FL/FR elettaria cardamomum seed oil FL/FR elettaria cardamomum seed oil guatemala FL/FR galangal root oleoresin FL myristica fragrans fruit extract FL/FR myristica fragrans seed tincture FL/FR nutmeg absolute FL/FR tea green tea leaf absolute FL/FR waxy nonanol FL/FR woody amyris wood oil FL/FR copaiba balsam FL/FR beta- damascenone FL/FR patchouli oil FL/FR sandalwood oil FL/FR sandalwood oil CO2 extract FL/FR vetiver oil bourbon FL/FR vetiver oil brazil FL/FR vetiver oil china FL/FR vetiver oil india FL/FR vetiverol FL/FR   Potential Uses: FR animal FL/FR birch tar FR castoreum FR civet FR date FR heather FR leather FR plum FR tobacco   Occurrence (nature, food, other):note   not found in nature   Synonyms:   butanoic acid 1-methyl-1-((3S,5R,8S)-1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl-5-azulenyl) ethyl ester   butanoic acid, 1-methyl-1-((3S,5R,8S)-1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl-5-azulenyl)ethyl ester 2-((3S,5R,8S)-3,8- dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl) propan-2-yl butanoate 2-[(3S,5R,8S)-3,8- dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-yl butanoate   guaiol butyrate (3S-(3alpha,5alpha,8alpha))-1- methyl-1-(1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl azulen-5-yl) ethyl butyrate (3S-(3a,5a,8a))-1- methyl-1-(1,2,3,4,5,6,7,8-octahydro-3,8-dimethylazulen-5-yl)ethyl butyrate   Articles:   None found yet. Try the PubMed Search.

Notes: None found

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