elemane
(1R,2S,4R)-1-ethyl-1-methyl-2,4-bis(1-methylethyl)cyclohexane
 
Notes:
None found
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CAS Number: 515-12-8Picture of molecule3D/inchi
Molecular Weight: 210.40410000
Formula: C15 H30
NMR Predictor: Predict (works with chrome or firefox)
Category: natural substances and extractives
 
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 250.00 to  252.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.033000 mmHg @ 25.00 °C. (est)
Flash Point: 215.00 °F. TCC ( 101.80 °C. ) (est)
logP (o/w): 7.386 (est)
Soluble in:
 alcohol
 water, 0.008123 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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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 elemane usage levels up to:
 not for fragrance use.
 
Recommendation for elemane flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
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EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
National Institute of Allergy and Infectious Diseases: Data
 (1R,2S,4R)-1-ethyl-1-methyl-2,4-bis(1-methylethyl)cyclohexane
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References:
 (1R,2S,4R)-1-ethyl-1-methyl-2,4-bis(1-methylethyl)cyclohexane
NIST Chemistry WebBook: Search Inchi
Pubchem (cas): 515-12-8
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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
Wikipedia: 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
 periploca laevigata root
Search Trop  Picture
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Synonyms:
(1R,2S,4R)-1-ethyl-1-methyl-2,4-bis(1-methylethyl)cyclohexane
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Articles:
PubMed: Non-natural elemane as the "stepping stone" for the synthesis of germacrane and guaiane sesquiterpenes.
PubMed: Phytochemical profile and apoptotic activity of Onopordum cynarocephalum.
PubMed: Ab initio analysis of the Cope rearrangement of germacrane sesquiterpenoids.
PubMed: Cytotoxic activity of some natural and synthetic sesquiterpene lactones.
PubMed: Sesquiterpenoid metabolites with antiplasmodial activity from a Caribbean gorgonian coral, Eunicea sp.
PubMed: Sesquiterpenes from Centaurea aspera.
PubMed: Sipaucins A-C, sesquiterpenoids from Siparuna pauciflora.
PubMed: Antiproliferative sesquiterpene lactones from the roots of Inula helenium.
PubMed: Secondary metabolites from Centaurea deusta with antimicrobial activity.
PubMed: Diterpenoids from the rhizomes of Alpinia calcarata.
PubMed: Synthesis of sesquiterpene derivatives as potential antitumor agents; elemane derivatives.
PubMed: New metabolites from onopordum illyricum
PubMed: Four aristolochic acid esters of rearranged ent-elemane sesquiterpenes from aristolochia heterophylla
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