methyl beta-ionol
1-penten-3-ol, 1-(2,6,6-trimethyl-1-cyclohexen-1-yl)-

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  CODE104685 CODE104685
  Product(s):
  93840-90-5 1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-ol

Name: (E)-1-(2,6,6-trimethyl-1-cyclohexenyl)pent-1-en-3-ol CAS Number: 93840-90-5 3D/inchi ECHA EINECS - REACH Pre-Reg: 298-957-4 FDA UNII: Search Nikkaji Web: J317.678I XlogP3: 3.40 (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: 50.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.91000 to 0.93000 @ 100.00 °C. Pounds per Gallon - (est).: 7.572 to 7.739 Refractive Index: 1.48500 to 1.50500 @ 20.00 °C. Boiling Point: 72.00 °C. @ 2.00 mm Hg Boiling Point: 298.00 to 299.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.000127 mmHg @ 25.00 °C. (est) Flash Point: 210.00 °F. TCC ( 98.89 °C. ) logP (o/w): 4.569 (est) Soluble in:   alcohol   water, 5.256 mg/L @ 25 °C (est)   Organoleptic Properties: Odor Type: fruity fruity berry Odor Description:at 100.00 %. fruity berry Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: BOC Sciences For experimental / research use only. 1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-ol   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 methyl beta-ionol usage levels up to:   3.0000 % in the fragrance concentrate.   Recommendation for methyl beta-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):93840-90-5 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :6437442 National Institute of Allergy and Infectious Diseases:Data (E)-1-(2,6,6-trimethyl-1-cyclohexenyl)pent-1-en-3-ol Chemidplus:0093840905   References:   (E)-1-(2,6,6-trimethyl-1-cyclohexenyl)pent-1-en-3-ol NIST Chemistry WebBook: Search Inchi Pubchem (cid): 6437442 Pubchem (sid): 135065850   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)-5- nonen-2-one FL/FR acidic acidic 2- ethyl butyric acid FL/FR 2- methyl-2-pentenoic acid FL/FR alliaceous methyl furfuryl disulfide FL/FR amber ambrette seed absolute FL/FR anisic para- anisyl propanal FR balsamic conifer acetate FR ethyl cinnamate FL/FR fir balsam absolute FR methyl (E)-cinnamate FL/FR methyl cinnamate FL/FR berry raspberry ketone FL/FR raspberry ketone acetate FL/FR raspberry ketone methyl ether FL/FR camphoreous alpha- campholenic alcohol FL/FR caramellic ethyl maltol FL/FR maltyl isobutyrate FL/FR maltyl propionate FL/FR strawberry furanone FL/FR earthy 3- octen-2-one FL/FR ethereal propyl formate FL/FR fermented valeraldehyde FL/FR floral cyclohexyl ethyl acetate FL/FR beta- damascenone FL/FR alpha- damascone FL/FR dihydro-alpha-ionone FL/FR ethyl ortho-anisate FL/FR heliotropyl acetate FL/FR heliotropyl acetone FL/FR hyacinth ether FR beta- ionone FL/FR beta- ionyl acetate FL/FR nerolin fragarol FL/FR orris rhizome resinoid (iris pallida) FL/FR phenethyl butyrate FL/FR phenethyl pivalate FL/FR rose carboxylate FR tetrahydroionyl acetate FR fruity acetyl methyl anthranilate FL/FR allyl benzoate FR iso amyl 2-methyl butyrate FL/FR artemisia pallens herb oil FL/FR benzyl butyrate FL/FR 3- benzyl-4-heptanone FL/FR berry hexanoate FR berry pentadienoate FL/FR bisabolene FL/FR iso butyl anthranilate FL/FR butyl anthranilate FL/FR iso butyl butyrate FL/FR butyl hexanoate FL/FR iso butyl isovalerate FL/FR butyl valerate FL/FR iso butyl-3-(methyl thio) butyrate FL/FR ethyl 2-hydroxy-3-methyl valerate FL/FR ethyl levulinate FL/FR ethyl methyl-para-tolyl glycidate FL/FR ethyl valerate FL/FR filbert hexenone FL/FR fruity ketal FL/FR geranyl butyrate FL/FR geranyl isovalerate FL/FR heliotropyl isobutyrate FL/FR hexyl isovalerate FL/FR beta- ionone epoxide FL/FR leather propionate FR methyl 2-methyl valerate FL/FR methyl heptanoate FL/FR methyl propionate FL/FR neryl isobutyrate FL/FR 3- nonen-2-one FL/FR octyl propionate FL/FR osmanthus flower absolute FL/FR 3- phenyl propyl isovalerate FL/FR phenyl propyl valerate FL/FR iso propenyl acetate FL/FR propyl acetate FL/FR propyl heptanoate FL/FR iso propyl hexanoate FL/FR propyl isobutyrate FL/FR prune glycidate FR strawberry glycidate 1 (aldehyde C-16 (so-called)) FL/FR strawberry glycidate 2 FL/FR styralyl butyrate FL/FR 4-(para- tolyl)-2-butanone FL/FR tropical trithiane FL/FR vanilla carboxylate FL/FR green acetaldehyde methyl hexyl acetal FR (Z)-3- hexen-1-yl 2-methyl butyrate FL/FR hexyl isobutyrate FL/FR hexyl octanoate FL/FR thiogeraniol FL/FR herbal artemisyl ketone FL/FR (S)- campholene acetate FL/FR iso dihydrolavandulal FL/FR herbal undecanone FR jammy ethyl 2-methyl-2-pentenoate FR mentholic menthyl acetate racemic FL/FR nutty 2- methyl-3-pentenoic acid FL/FR phenolic ortho- cresyl isobutyrate FL/FR soapy ambrettolide FL/FR sulfurous blackberry thiophenone FL/FR buchu mercaptan FL/FR mango thiol FL/FR 2- phenethyl isothiocyanate FL/FR terpenic pine needle oil dwarf FL/FR waxy (E)-2- octen-1-yl butyrate FL/FR woody bornyl valerate FL/FR For Flavor No flavor group found for these allyl tiglate FL artemisyl ketone FL/FR blackberry thiophenone FL/FR iso butyl-3-(methyl thio) butyrate FL/FR alpha- campholenic alcohol FL/FR ortho- cresyl isobutyrate FL/FR ethyl 2-hydroxy-3-methyl valerate FL/FR ethyl ortho-anisate FL/FR beta- ionone epoxide FL/FR menthyl acetate racemic FL/FR methyl (E)-cinnamate FL/FR 2- methyl-3-pentenoic acid FL/FR (E)-5- nonen-2-one FL/FR (E)-2- octen-1-yl butyrate FL/FR (E)-2- octen-4-ol FL 2- phenethyl isothiocyanate FL/FR 3- phenyl propyl isovalerate FL/FR phenyl propyl valerate FL/FR iso propyl hexanoate FL/FR (E)- spicy acrolein FL acidic acidic 2- ethyl butyric acid FL/FR balsamic ethyl cinnamate FL/FR phenethyl pivalate FL/FR berry dihydro-alpha-ionone FL/FR heliotropyl acetone FL/FR raspberry ketone FL/FR raspberry ketone acetate FL/FR raspberry ketone methyl ether FL/FR caramellic ethyl maltol FL/FR maltyl propionate FL/FR strawberry furanone FL/FR citrus bisabolene FL/FR coffee methyl furfuryl disulfide FL/FR creamy acetoin butyrate FL 3- octen-2-one FL/FR estery octyl propionate FL/FR propyl acetate FL/FR ethereal iso propenyl acetate FL/FR floral heliotropyl acetate FL/FR orris rhizome resinoid (iris pallida) FL/FR fruity acetyl methyl anthranilate FL/FR iso amyl 2-methyl butyrate FL/FR artemisia pallens herb oil FL/FR benzyl butyrate FL/FR 3- benzyl-4-heptanone FL/FR berry pentadienoate FL/FR butyl anthranilate FL/FR iso butyl anthranilate FL/FR iso butyl butyrate FL/FR butyl hexanoate FL/FR butyl valerate FL/FR alpha- damascone FL/FR ethyl 3-oxohexanoate FL ethyl levulinate FL/FR ethyl methyl-para-tolyl glycidate FL/FR ethyl valerate FL/FR filbert hexenone FL/FR fruity ketal FL/FR furfuryl isovalerate FL geranyl butyrate FL/FR heliotropyl isobutyrate FL/FR methyl 2-methyl valerate FL/FR methyl heptanoate FL/FR methyl propionate FL/FR nerolin fragarol FL/FR neryl isobutyrate FL/FR osmanthus flower absolute FL/FR phenethyl butyrate FL/FR propyl formate FL/FR propyl isobutyrate FL/FR strawberry glycidate 1 (aldehyde C-16 (so-called)) FL/FR strawberry glycidate 2 FL/FR styralyl butyrate FL/FR 4-(para- tolyl)-2-butanone FL/FR tropical trithiane FL/FR vanilla carboxylate FL/FR green iso butyl isovalerate FL/FR cyclohexyl ethyl acetate FL/FR geranyl isovalerate FL/FR (Z)-3- hexen-1-yl 2-methyl butyrate FL/FR hexyl isobutyrate FL/FR hexyl isovalerate FL/FR hexyl octanoate FL/FR thiogeraniol FL/FR herbal iso dihydrolavandulal FL/FR jammy (S)- campholene acetate FL/FR maltyl isobutyrate FL/FR oily 3- nonen-2-one FL/FR pine pine needle oil dwarf FL/FR soapy ambrettolide FL/FR sour 2- methyl-2-pentenoic acid FL/FR spicy methyl cinnamate FL/FR sulfurous buchu mercaptan FL/FR mango thiol FL/FR waxy propyl heptanoate FL/FR winey valeraldehyde FL/FR woody ambrette seed absolute FL/FR bornyl valerate FL/FR beta- damascenone FL/FR beta- ionone FL/FR beta- ionyl acetate FL/FR   Potential Uses: FR berry FR blueberry FR butterscotch FL caramel FR cotton candy FR geranium FR jasmin FR raspberry FR rose FR strawberry   Occurrence (nature, food, other):note   not found in nature   Synonyms: beta- methyl ionol 1- penten-3-ol, 1-(2,6,6-trimethyl-1-cyclohexen-1-yl)- 1-(2,6,6- trimethyl-1-cyclohexen-1-yl) pent-1-en-3-ol 1-(2,6,6- trimethyl-1-cyclohexen-1-yl)pent-1-en-3-ol (E)-1-(2,6,6- trimethyl-1-cyclohexenyl)pent-1-en-3-ol   Articles:   None found yet. 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Notes: None found