trans-dihydrocarvone
trans-2-methyl-5-(1-methylethenyl)cyclohexanone
 
Notes:
None found
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(2R,5R)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-one (Click)
CAS Number: 5948-04-9Picture of molecule
FDA UNII: VTA43H364Z
Nikkaji Web: J995.644A
XlogP3-AA: 2.70 (est)
Molecular Weight: 152.23672000
Formula: C10 H16 O
NMR Predictor: Predict (works with chrome or firefox)
Category: natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: Search
Google Books: Search
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US Patents: Search
EU Patents: Search
IBM Patents: Obtain
Pubchem Patents: Search
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 92.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 220.00 to  222.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.107000 mm/Hg @ 25.00 °C. (est)
Flash Point: 181.00 °F. TCC ( 82.78 °C. )
logP (o/w): 3.225 (est)
Soluble in:
 alcohol
 water, 273.1 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
Odor Strength: medium
Odor Description:
at 100.00 %. 
warm herbal
  
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Cosmetic Information:
None found
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Suppliers:
 None found
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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
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Safety in Use Information:
Category: natural substances and extractives
Recommendation for trans-dihydrocarvone usage levels up to:
 not for fragrance use.
 
Recommendation for trans-dihydrocarvone flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 22227
National Institute of Allergy and Infectious Diseases: Data
 (2R,5R)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-one
Chemidplus: 0005524050
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References:
Leffingwell: chirality
 (2R,5R)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-one
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 22227
Pubchem (sid): 135050984
Flavornet: 5948-04-9
Pherobase: View
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Other Information:
(IUPAC): Atomic Weights of the Elements 2009
(IUPAC): Atomic Weights of the Elements 2009 (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
KEGG (GenomeNet): C11398
HMDB (The Human Metabolome Database): Search
FooDB: FDB003876
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
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Synonyms:
(2R,5R)-dihydrocarvone
trans-p-menth-8-en-2-one
trans-para-menth-8-en-2-one
trans-2-methyl-5-(1-methyl ethenyl) cyclohexanone
trans-2-methyl-5-(1-methylethenyl)cyclohexanone
(2R,5R)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-one
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Articles:
PubMed: Controlling the Regioselectivity of Baeyer-Villiger Monooxygenases by Mutation of Active-Site Residues.
PubMed: Switching the Regioselectivity of a Cyclohexanone Monooxygenase toward (+)-trans-Dihydrocarvone by Rational Protein Design.
PubMed: Total synthesis of (+)-pleuromutilin.
PubMed: Insecticidal and acetylcholine esterase inhibition activity of Apiaceae plant essential oils and their constituents against adults of German cockroach (Blattella germanica).
PubMed: Antibacterial activity of Cuminum cyminum L. and Carum carvi L. essential oils.
PubMed: Odor differences between enantiomeric isomers.
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