beta-pinone
bicyclo[3.1.1]heptan-2-one, 6,6-dimethyl-
 
Notes:
None found
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CAS Number: 24903-95-5Picture of molecule3D/inchi
Other(deleted CASRN): 30469-48-8
ECHA EINECS - REACH Pre-Reg: 246-520-3
Nikkaji Web: J286.419C
XlogP3-AA: 1.60 (est)
Molecular Weight: 138.20978000
Formula: C9 H14 O
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome or firefox)
Category: natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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Physical Properties:
Appearance: colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 196.00 to  197.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.402000 mmHg @ 25.00 °C. (est)
Flash Point: 150.00 °F. TCC ( 65.50 °C. ) (est)
logP (o/w): 1.808 (est)
Soluble in:
 alcohol
 water, 522 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 beta-pinone usage levels up to:
 not for fragrance use.
 
Recommendation for beta-pinone flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 24903-95-5
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 32735
National Institute of Allergy and Infectious Diseases: Data
 6,6-dimethylbicyclo[3.1.1]heptan-2-one
Chemidplus: 0024903955
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References:
 6,6-dimethylbicyclo[3.1.1]heptan-2-one
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 24903-95-5
Pubchem (cid): 32735
Pubchem (sid): 134996356
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: FDB006615
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
 nepeta cephalotes boiss. oil iran @ 2.50%
Data  GC  Search Trop  Picture
 parkia biglobosa
Search Trop  Picture
 pepper black pepper plant
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 philadelphus coronarius
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 xenophyllum incisum
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Synonyms:
 bicyclo(3.1.1)heptan-2-one, 6,6-dimethyl-
 bicyclo[3.1.1]heptan-2-one, 6,6-dimethyl-
6,6-dimethyl bicyclo(3.1.1)heptan-2-one
6,6-dimethyl-2-norpinanone
6,6-dimethylbicyclo(3.1.1)heptan-2-one
6,6-dimethylbicyclo[3.1.1]heptan-2-one
 nopinon
 nopinone
2-norpinanone, 6,6-dimethyl-
2-norpinanone, 6,6-dimethyl- (8CI)
b-pinone
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