alpha-isomethyl ionol
3-buten-2-ol, 3-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-

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Name: 3-methyl-4-(2,6,6-trimethyl-1-cyclohexenyl)but-3-en-2-ol CAS Number: 51595-91-6 3D/inchi ECHA EINECS - REACH Pre-Reg: 257-310-6 FDA UNII: Search XlogP3-AA: 3.60 (est) Molecular Weight: 208.34448000 Formula: C14 H24 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 sum of isomers Food Chemicals Codex Listed: No Specific Gravity: 0.91000 to 0.93000 @ 25.00 °C. Pounds per Gallon - (est).: 7.572 to 7.739 Refractive Index: 1.49000 to 1.51000 @ 20.00 °C. Boiling Point: 225.00 °C. @ 3.00 mm Hg Vapor Pressure: 0.000125 mmHg @ 25.00 °C. (est) Flash Point: 210.00 °F. TCC ( 98.89 °C. ) logP (o/w): 4.478 (est) Soluble in:   alcohol   water, 4.706 mg/L @ 25 °C (est)   Organoleptic Properties: Odor Type: woody woody vetiver Odor Description:at 100.00 %. woody vetiver acetate Odor and/or flavor descriptions from others (if found). Bedoukian Research alpha-ISOMETHYL IONOL Odor Description:A woody vetivert-type odor. Used in violet compositions.   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 alpha-isomethyl ionol usage levels up to:   2.0000 % in the fragrance concentrate.   Recommendation for alpha-isomethyl ionol 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):51595-91-6 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :103499 National Institute of Allergy and Infectious Diseases:Data 3-methyl-4-(2,6,6-trimethyl-1-cyclohexenyl)but-3-en-2-ol Chemidplus:0051595916   References:   3-methyl-4-(2,6,6-trimethyl-1-cyclohexenyl)but-3-en-2-ol NIST Chemistry WebBook: Search Inchi Pubchem (cid): 103499 Pubchem (sid): 135060831   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 ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these (E)- sabinene hydrate FL/FR amber amber acetoxymethyl isolongifolene FR amber spirolene FR formoxymethyl isolongifolene FR animal iso butyl quinoline FR anisic para- anisyl phenyl acetate FL/FR balsamic siam benzoin absolute FL/FR siam benzoin resinoid FL/FR 1- benzoyl acetone FL/FR laevo- bornyl acetate FL/FR brachyleana hutchinsii wood oil FR conifer acetate FR fir needle oil canada FL/FR fir needle oil terpeneless canada FL/FR guaiyl butyrate FR hemlock western oil (tsuga heterophylla) canada FR juniper berry absolute FL/FR methyl hydrogenated rosinate FR myrrh absolute FL/FR myrrh resinoid FR tolu balsam absolute FL/FR tolu balsam resin FL/FR tolu balsam resinoid FL/FR citrus grapefruit indene FR grapefruit nitrile FR grapefruit pentanol FR earthy patchouli cyclohexanol FR floral cananga oil FL/FR cananga oil china FL/FR ho wood oil FR alpha- ionol FL/FR alpha- ionyl acetate FR methyl ionyl acetate FL/FR phenyl glycol diacetate FR rose absolute (rosa centifolia) morocco FL/FR vetiver pentanone FR green bergoxane FR galbanum absolute FL/FR galbanum oleoresin FL/FR galbanum resinoid FL/FR iso green methanoindene FR (E)-2- hexen-1-yl salicylate FR valerian rhizome oil CO2 extract china FL/FR herbal canarium luzonicum gum FL/FR immortelle flower oil FL/FR rosemary absolute FL/FR rosemary oil morocco FL/FR rosemary oil spain FL/FR valerian rhizome oil FL/FR valerian rhizome oil china FL/FR orris beta- methyl ionone FL/FR spicy elettaria cardamomum seed oil FL/FR nutmeg absolute FL/FR spicy carbonate FR terpenic elemi resinoid FL/FR pine needle oil dwarf FL/FR woody amyris acetate FR iso butyl ionone FR cedar cyclododecatriene FR cedryl formate FR copaiba balsam FL/FR dihydro-beta-ionol FL/FR guaiacwood oil 20% in gurjun balsam oil FR alpha- guaiene FL/FR gurjun balsam oil FR alpha- gurjunene FR herbal norbornane FR 4- hydroxybenzaldehyde FL/FR methyl cedryl ketone FL/FR iso methyl tetrahydroionyl acetate FR patchouli ethanone FR patchouli oil FL/FR sandalwood oil FL/FR sandalwood oil west australia (santalum spicatum) FR santalyl butyrate FL/FR vetiverol FL/FR vetiveryl acetate FL/FR (Z)- woody amylene FR For Flavor No flavor group found for these 1- benzoyl acetone FL/FR dihydro-beta-ionol FL/FR fir needle oil canada FL/FR alpha- guaiene FL/FR (E)- sabinene hydrate FL/FR santalyl butyrate FL/FR vetiveryl acetate FL/FR anisic anisic para- anisyl phenyl acetate FL/FR balsamic siam benzoin resinoid FL/FR laevo- bornyl acetate FL/FR fir needle oil terpeneless canada FL/FR juniper berry absolute FL/FR myrrh absolute FL/FR peru balsam FL tolu balsam absolute FL/FR tolu balsam resin FL/FR tolu balsam resinoid FL/FR creamy 4- hydroxybenzaldehyde FL/FR floral cananga oil FL/FR cananga oil china FL/FR beta- methyl ionone FL/FR rose absolute (rosa centifolia) morocco FL/FR fruity valerian rhizome oil FL/FR valerian rhizome oil china FL/FR valerian rhizome oil CO2 extract china FL/FR green canarium luzonicum gum FL/FR elemi resinoid FL/FR galbanum absolute FL/FR galbanum oleoresin FL/FR galbanum resinoid FL/FR herbal immortelle flower oil FL/FR rosemary absolute FL/FR rosemary oil morocco FL/FR rosemary oil spain FL/FR pine pine needle oil dwarf FL/FR spicy siam benzoin absolute FL/FR elettaria cardamomum seed oil FL/FR galangal root oleoresin FL nutmeg absolute FL/FR woody copaiba balsam FL/FR alpha- ionol FL/FR methyl cedryl ketone FL/FR methyl ionyl acetate FL/FR patchouli oil FL/FR sandalwood oil FL/FR vetiverol FL/FR   Potential Uses: FR moss FR oriental FR vetiver FR violet FR woody   Occurrence (nature, food, other):note   not found in nature   Synonyms: 3- buten-2-ol, 3-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- 3- methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3-buten-2-ol 3- methyl-4-(2,6,6-trimethyl-1-cyclohexenyl)but-3-en-2-ol 3- methyl-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-ol   Articles:   None found yet. Try the PubMed Search.

Notes: None found

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