alpha-acoradiene
(1S)-1,8-dimethyl-4-prop-1-en-2-ylspiro[4.5]dec-7-ene
 
Notes:
None found
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CAS Number: 24048-44-0Picture of molecule3D/inchi
Nikkaji Web: J16.738J
XlogP3-AA: 4.90 (est)
Molecular Weight: 204.35628000
Formula: C15 H24
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: 270.00 to  271.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.011000 mmHg @ 25.00 °C. (est)
Flash Point: 223.00 °F. TCC ( 106.00 °C. ) (est)
logP (o/w): 6.311 (est)
Soluble in:
 alcohol
 water, 0.01305 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items: note
acoradiene
beta-acoradiene
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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 alpha-acoradiene usage levels up to:
 not for fragrance use.
 
Recommendation for alpha-acoradiene 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
Laboratory Chemical Safety Summary : 6429151
National Institute of Allergy and Infectious Diseases: Data
 (1S)-1,8-dimethyl-4-prop-1-en-2-ylspiro[4.5]dec-7-ene
Chemidplus: 0024048440
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References:
 (1S)-1,8-dimethyl-4-prop-1-en-2-ylspiro[4.5]dec-7-ene
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 6429151
Pubchem (sid): 135045840
Pherobase: View
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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
Typical G.C.
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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 guava leaf oil cuba @ 0.20%
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Synonyms:
.alpha.-acoradiene
4,11-acoradiene
a-acoradiene
(1S)-1,8-dimethyl-4-prop-1-en-2-ylspiro[4.5]dec-7-ene
(1S)-1,8-dimethyl-4-propan-2-ylspiro[4.5]deca-3,9-diene
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Articles:
PubMed: Extraction of essential oil from Cupressus sempervirens: comparison of global yields, chemical composition and antioxidant activity obtained by hydrodistillation and supercritical extraction.
PubMed: Solid-phase microextraction (SPME) analysis of six Italian populations of Ephedra nebrodensis Tineo ex Guss. subsp. nebrodensis.
PubMed: Bisabolyl-derived sesquiterpenes from tobacco 5-epi-aristolochene synthase-catalyzed cyclization of (2Z,6E)-farnesyl diphosphate.
PubMed: Synthetic examination of incorrectly proposed structures of biomolecules.
PubMed: Revision of the structure of the major aggregation pheromone of the broad-horned flour beetle (Gnatocerus cornutus) to (1S,4R,5R)-alpha-acoradiene by its synthesis.
PubMed: Cloning, expression, and characterization of epi-cedrol synthase, a sesquiterpene cyclase from Artemisia annua L.
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