artemisyl acetate
3,3,6-trimethyl-1,5-heptadien-4-yl acetate
 
Notes:
From Artemisia spp.
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CAS Number: 3465-88-1Picture of molecule3D/inchi
Nikkaji Web: J2.373.715I
XlogP3-AA: 3.60 (est)
Molecular Weight: 196.28980000
Formula: C12 H20 O2
NMR Predictor: Predict (works with chrome or firefox)
Category: natural substances and extractives
 
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Physical Properties:
Appearance: colorless to pale yellow clear liquid (est)
Assay: 96.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 241.00 to  242.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.036000 mmHg @ 25.00 °C. (est)
Flash Point: 175.00 °F. TCC ( 79.44 °C. )
logP (o/w): 3.571 (est)
Soluble in:
 alcohol
 water, 9.472 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 artemisyl acetate usage levels up to:
 not for fragrance use.
 
Recommendation for artemisyl acetate 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 : 524254
National Institute of Allergy and Infectious Diseases: Data
 3,3,6-trimethylhepta-1,5-dien-4-yl acetate
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References:
 3,3,6-trimethylhepta-1,5-dien-4-yl acetate
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 524254
Pubchem (sid): 10540442
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): HMDB36048
FooDB: FDB014870
Export Tariff Code: 2915.39.9050
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
 bombycilaena erecta oil greece @ 10.70%
Data  GC  Search Trop  Picture
 layana oil wild zimbabwe @ trace-0.10%
Data  GC  Search Trop  Picture
 otanthus maritimus (l.) hoffmans oil greece @ 10.50%
Data  GC  Search Trop  Picture
 wormwood oil annus france @ 0.00-0.07%
Data  GC  Search Trop  Picture
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Synonyms:
 artemisia acetate
 artemisia alcohol acetate
 artemisia alcohol, acetate
3,3,6-trimethyl-1,5-heptadien-4-yl acetate
3,3,6-trimethylhepta-1,5-dien-4-yl acetate
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