pseudo-isomethyl ionone

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Name: (3E,5E)-3,6,10-trimethylundeca-3,5,9-trien-2-one CAS Number: 1117-41-5 3D/inchi Other(deleted CASRN): 5659-78-9 ECHA EINECS - REACH Pre-Reg: 214-245-8 FDA UNII: Search XlogP3-AA: 4.30 (est) Molecular Weight: 206.32854000 Formula: C14 H22 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: Assay: 50.00 to 100.00 sum of isomers Food Chemicals Codex Listed: No Boiling Point: 311.00 to 313.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.000493 mmHg @ 25.00 °C. (est) Flash Point: 279.00 °F. TCC ( 137.22 °C. ) logP (o/w): 4.246 (est) Soluble in:   alcohol   water, 2.271 mg/L @ 25 °C (est)   Organoleptic Properties: Odor and/or flavor descriptions from others (if found).   Cosmetic Information: CosIng: cosmetic data Cosmetic Uses: not used anymore   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: oral-rat LDLo 5000 mg/kg Food and Chemical Toxicology. Vol. 26, Pg. 413, 1988. Dermal Toxicity: skin-rabbit LD50 > 2500 mg/kg Food and Chemical Toxicology. Vol. 26, Pg. 413, 1988. Inhalation Toxicity: Not determined   Safety in Use Information: Category: information only not used for fragrances or flavors IFRA Critical Effect: Dermal sensitization   View the IFRA Standard Recommendation for pseudo-isomethyl ionone usage levels up to:   PROHIBITED: Should not be used as a fragrance ingredient.   Recommendation for pseudo-isomethyl ionone 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):1117-41-5 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :6436890 National Institute of Allergy and Infectious Diseases:Data SCCNFP:opinion (3E,5E)-3,6,10-trimethylundeca-3,5,9-trien-2-one Chemidplus:0001117415   References:   (3E,5E)-3,6,10-trimethylundeca-3,5,9-trien-2-one NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 1117-41-5 Pubchem (cid): 6436890 Pubchem (sid): 135058384   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: 2914.23.0000 ChemSpider: View   Potential Blenders and core components note None Found   Potential Uses: None Found   Occurrence (nature, food, other):note   not found in nature   Synonyms: pseudo-iso methyl ionone   methyl isopseudoionone iso methyl pseudoionone   methylisopseudoionone 3,6,10- trimethyl undeca-3,5,9-trien-2-one (3E,5E)-3,6,10- trimethyl-3,5,9-undecatrien-2-one 2,6,9- trimethylundeca-2,6,8-trien-10-one (3E,5E)-3,6,10- trimethylundeca-3,5,9-trien-2-one 3,6,10- trimethylundeca-3,5,9-trien-2-one 3,5,9- undecatrien-2-one, 3,6,10-trimethyl- 3,5,9- undecatrien-2-one, 3,6,10-trimethyl-, (3E,5E)-   Articles:   None found yet. Try the PubMed Search.

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