(E)-buchu mercaptan
trans-8-mercapto-para-menthan-3-one

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Name: (2R,5R)-5-methyl-2-(2-sulfanylpropan-2-yl)cyclohexan-1-one CAS Number: 33281-91-3 3D/inchi ECHA EINECS - REACH Pre-Reg: 251-440-7 FDA UNII: Search Nikkaji Web: J313.834H XlogP3-AA: 2.30 (est) Molecular Weight: 186.31766000 Formula: C10 H18 O S NMR Predictor: Predict (works with chrome, Edge or firefox) Category:flavor and 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 Google Patents: Search US Patents: Search EU Patents: Search Pubchem Patents: Search PubMed: Search NCBI: Search   Physical Properties: Appearance: colorless to pale yellow clear liquid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Boiling Point: 273.09 °C. @ 760.00 mm Hg (est) Vapor Pressure: 0.006000 mmHg @ 25.00 °C. (est) Flash Point: 227.00 °F. TCC ( 108.30 °C. ) (est) logP (o/w): 2.624 (est) Soluble in:   alcohol   water, 218.4 mg/L @ 25 °C (est) Insoluble in:   water   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: flavor and fragrance agents RIFM Fragrance Material Safety Assessment: Search IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice     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 :6951712 National Institute of Allergy and Infectious Diseases:Data (2R,5R)-5-methyl-2-(2-sulfanylpropan-2-yl)cyclohexan-1-one Chemidplus:0033281913   References:   (2R,5R)-5-methyl-2-(2-sulfanylpropan-2-yl)cyclohexan-1-one NIST Chemistry WebBook: Search Inchi Pubchem (cid): 6951712 Pubchem (sid): 43559602   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 Typical G.C. 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   agathosma betulina leaf oil @ 0.53% Data GC Search Trop Picture   buchu leaf oil Search Trop Picture   Synonyms: (2R,5R)- buchu mercaptan   cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, (2R,5R)-   cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, trans- (E)-3-oxo-para- menthan-8-thiol trans-2-(1- mercapto-1-methylethyl)-5-methylcyclohexan-1-one (E)-8- mercapto-p-menthan-3-one trans-8- mercapto-p-menthan-3-one (E)-8- mercapto-para-menthan-3-one trans-8- mercapto-para-menthan-3-one (2R,5R)-5- methyl-2-(2-sulfanylpropan-2-yl)cyclohexan-1-one (2R,5R)-5- methyl-2-(2-sulfanylpropan-2-yl)cyclohexanone   Articles:   None found yet. Try the PubMed Search.

Notes: None found

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