(E,Z)-tobacco cyclohexenone
(E,Z)-tabanone

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Name: (4E)-4-[(Z)-but-2-enylidene]-3,5,5-trimethylcyclohex-2-en-1-one CAS Number: 5298-13-5 3D/inchi % from: 50.00% ECHA EINECS - REACH Pre-Reg: 226-145-1 FDA UNII: ER2A7N6WBO XlogP3-AA: 2.60 (est) Molecular Weight: 190.28566000 Formula: C13 H18 O NMR Predictor: Predict (works with chrome, Edge or firefox) Category:information only not used for fragrances or flavors   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: pale yellow to yellow clear liquid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Boiling Point: 289.00 to 290.00 °C. @ 760.00 mm Hg (est) Vapor Pressure: 0.002000 mmHg @ 25.00 °C. (est) Flash Point: 257.00 °F. TCC ( 124.80 °C. ) (est) logP (o/w): 3.588 (est) Soluble in:   alcohol   water, 12.48 mg/L @ 25 °C (est)   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: information only not used for fragrances or flavors Recommendation for (E,Z)-tobacco cyclohexenone usage levels up to:   not for fragrance use.   Recommendation for (E,Z)-tobacco cyclohexenone 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 :6437596 National Institute of Allergy and Infectious Diseases:Data (4E)-4-[(Z)-but-2-enylidene]-3,5,5-trimethylcyclohex-2-en-1-one Chemidplus:0005298135   References:   (4E)-4-[(Z)-but-2-enylidene]-3,5,5-trimethylcyclohex-2-en-1-one NIST Chemistry WebBook: Search Inchi Pubchem (cid): 6437596 Pubchem (sid): 135066901   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 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note None Found   Potential Uses: None Found   Occurrence (nature, food, other):note   plumcot fruit Search PMC Picture   tobacco Search Trop Picture   Synonyms: (E,Z)-4- but-2-enylidene-3,5,5-trimethyl cyclohex-2-enone (4E)-4-[(Z)- but-2-enylidene]-3,5,5-trimethylcyclohex-2-en-1-one (E,Z)- butenylidene trimethyl cyclohexenone (4E)-4-((2Z)- butenylidene)-3,5,5-trimethyl cyclohex-2-en-1-one (E,Z)-4-(2- butenylidene)-3,5,5-trimethyl cyclohex-2-en-1-one (E,Z)-4-( butenylidene)-3,5,5-trimethyl-2-cyclohexen-1-one (E,Z)-4-(2- butenylidene)-3,5,5-trimethylcyclohex-2-en-1-one (E,Z)- megastigma-4,6,8-trien-3-one (E,Z)- megastigmatrienone (E,Z)- tabanone   Articles:   None found yet. Try the PubMed Search.

Notes: None found

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