(E)-beta-ionone epoxide
3-buten-2-one, 4-(2,2,6-trimethyl-7-oxabicyclo(4.1.0)hept-1-yl)-, (E)-

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Name: (E)-4-(1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)but-3-en-2-one CAS Number: 36340-49-5 3D/inchi FDA UNII: KAT5VL2Y08 Nikkaji Web: J183.661G XlogP3-AA: 2.00 (est) Molecular Weight: 208.30080000 Formula: C13 H20 O2 NMR Predictor: Predict (works with chrome, Edge or firefox) Category:natural substances and extractives   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 Google Patents: Search US Patents: Search EU Patents: Search Pubchem Patents: Search PubMed: Search NCBI: Search   Physical Properties: Appearance: white to pale yellow crystalline solid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Boiling Point: 275.00 to 276.00 °C. @ 760.00 mm Hg (est) Vapor Pressure: 0.005000 mmHg @ 25.00 °C. (est) Flash Point: 219.00 °F. TCC ( 103.70 °C. ) (est) logP (o/w): 1.864 (est) Soluble in:   alcohol   water, 123.6 mg/L @ 25 °C (est) Insoluble in:   water Similar Items:note beta-ionone epoxide   Organoleptic Properties: 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: natural substances and extractives Recommendation for (E)-beta-ionone epoxide usage levels up to:   not for fragrance use.   Recommendation for (E)-beta-ionone epoxide flavor usage levels up to:   not for flavor use.   Safety References: EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :5352481 National Institute of Allergy and Infectious Diseases:Data (E)-4-(1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)but-3-en-2-one Chemidplus:0036340495   References:   (E)-4-(1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)but-3-en-2-one NIST Chemistry WebBook: Search Inchi Pubchem (cid): 5352481 Pubchem (sid): 135125177   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 CHEBI: View CHEMBL: View HMDB (The Human Metabolome Database): Search VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note None Found   Potential Uses: FR ambergris   Occurrence (nature, food, other):note   found in nature   Synonyms: 3- buten-2-one, 4-(2,2,6-trimethyl-7-oxabicyclo(4.1.0)hept-1-yl)-, (E)- (E)-4-(1,2- epoxy-2,6,6-trimethylcyclohexan-1-yl)-3-buten-2-one 5,6- epoxy-b-ionone (E)-5,6- epoxy-beta-ionone 5,6-beta- epoxyionone b- ionon-5,6-epoxide beta- ionon-5,6-epoxide (E)-4-(2,2,6- trimethyl-7-oxabicyclo(4.1.0)hept-1-yl)-3-buten-2-one (E)-4-(1,5,5- trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)but-3-en-2-one   Articles: US Patents:3,931,326 - Alkenoyl-cyclohexadienes US Patents:Flavoring phenol or phenol derivative containing food or feed with cycloaliphatic derivatives

Notes: None found

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