beta-thujene
bicyclo[3.1.0]hex-2-ene, 4-methyl-1-(1-methylethyl)-
 
Notes:
None found
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CAS Number: 28634-89-1Picture of molecule3D/inchi
Nikkaji Web: J101.190A
XlogP3-AA: 3.40 (est)
Molecular Weight: 136.23752000
Formula: C10 H16
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: 147.00 °C. @ 739.00 mm Hg
Soluble in:
 water, 3.756 mg/L @ 25 °C (est)
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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 beta-thujene usage levels up to:
 not for fragrance use.
 
Recommendation for beta-thujene 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 : 520384
National Institute of Allergy and Infectious Diseases: Data
 4-methyl-1-propan-2-ylbicyclo[3.1.0]hex-2-ene
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References:
 4-methyl-1-propan-2-ylbicyclo[3.1.0]hex-2-ene
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 520384
Pubchem (sid): 241049026
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
FooDB: FDB006920
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
 allspice japanese allspice
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 rosemary sap
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 syringa oblata var. alba
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Synonyms:
 bicyclo[3.1.0]hex-2-ene, 4-methyl-1-(1-methylethyl)-
4-methyl-1-propan-2-ylbicyclo[3.1.0]hex-2-ene
1-isopropyl-4-methylbicyclo[3.1.0]hex-2-ene
2-thujene
b-thujene
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Articles:
PubMed: Chemical Composition and Bioactivity of Essential Oil of Atalantia guillauminii against Three Species Stored Product Insects.
PubMed: The floral transcriptome of ylang ylang (Cananga odorata var. fruticosa) uncovers biosynthetic pathways for volatile organic compounds and a multifunctional and novel sesquiterpene synthase.
PubMed: Chemical composition and biological activity of four salvia essential oils and individual compounds against two species of mosquitoes.
PubMed: Effect of second cooling on the chemical components of essential oils from orange peel (Citrus sinensis).
PubMed: Phytochemistry and antifungal properties of the newly discovered tree Pleodendron costaricense.
PubMed: Antibacterial and antifungal effects of essential oils from coniferous trees.
PubMed: Flavor compounds of pine sprout tea and pine needle tea.
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