(E)-tagetenone
trans-tagetenone
 
Notes:
None found
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CAS Number: 33746-72-4Picture of molecule3D/inchi
Nikkaji Web: J2.305.228H
XlogP3-AA: 3.30 (est)
Molecular Weight: 150.22078000
Formula: C10 H14 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
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
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 226.00 to  228.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.079000 mmHg @ 25.00 °C. (est)
Flash Point: 186.00 °F. TCC ( 85.56 °C. )
logP (o/w): 1.921 (est)
Soluble in:
 alcohol
 water, 192.9 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:
Santa Cruz Biotechnology
For experimental / research use only.
(E)-Tagetenone
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Safety Information:
Preferred SDS: View
 
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 (E)-tagetenone usage levels up to:
 not for fragrance use.
 
Recommendation for (E)-tagetenone 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 : 6428431
National Institute of Allergy and Infectious Diseases: Data
 (5E)-2,6-dimethylocta-2,5,7-trien-4-one
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References:
 (5E)-2,6-dimethylocta-2,5,7-trien-4-one
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 6428431
Pubchem (sid): 10544200
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
 ferula cupularis stem oil @ 0.38%
Data  GC  Search Trop  Picture
 tagete oil CO2 extract @ 0.65%
Data  GC  Search Trop  Picture
 tagete oil egypt @ 1.13%
Data  GC  Search Trop  Picture
 tagete oil rwanda @ 1.80%
Data  GC  Search Trop  Picture
 tagete oil rwanda @ 6.31%
Data  GC  Search Trop  Picture
 tagete oil turkey @ 15.35%
Data  GC  Search Trop  Picture
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Synonyms:
(5E)-2,6-dimethyl octa-2,5,7-trien-4-one
(E)-ocimenone
trans-ocimenone
trans-tagetenone
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Articles:
 None found yet.
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