alpha-patchoulene
2,3,6,7,8,8alpha-hexahydro-1,4,9,9-tetramethyl-1H-3alpha,7-methanoazulene
 
Notes:
None found
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CAS Number: 560-32-7Picture of molecule3D/inchi
XlogP3-AA: 4.80 (est)
Molecular Weight: 204.35628000
Formula: C15 H24
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
PubMed: Search
NCBI: Search
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 262.00 to  263.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.018000 mmHg @ 25.00 °C. (est)
Flash Point: 230.00 °F. TCC ( 110.00 °C. )
logP (o/w): 6.308 (est)
Soluble in:
 water, 0.1504 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 alpha-patchoulene usage levels up to:
 not for fragrance use.
 
Recommendation for alpha-patchoulene 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 ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 5320423
National Institute of Allergy and Infectious Diseases: Data
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References:
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 5320423
Pubchem (sid): 39293987
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
 geranium rose-scented oil (pelargonium spp.) cuba @ 0.60%
Data  GC  Search Trop  Picture
 patchouli oil @ 22.20%
Data  GC  Search Trop  Picture
 patchouli oil china @ 8.48%
Data  GC  Search Trop  Picture
 pineapple fruit
Search Trop  Picture
 spikenard oil @ 29.80%
Data  GC  Search Trop  Picture
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Synonyms:
2,3,6,7,8,8alpha-hexahydro-1,4,9,9-tetramethyl-1H-3alpha,7-methanoazulene
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Articles:
PubMed: Characteristic Changes in the Aroma Profile of Patchouli Depending on Manufacturing Process.
PubMed: Effect of patchouli (Pogostemon cablin) essential oil on in vitro and in vivo leukocytes behavior in acute inflammatory response.
PubMed: Essential oil composition of valeriana jatamansi jones from himalayan regions of India.
PubMed: A Comprehensive Review on the Phytochemical Constituents and Pharmacological Activities of Pogostemon cablin Benth.: An Aromatic Medicinal Plant of Industrial Importance.
PubMed: Quantitative and physical evaluation of patchouli essential oils obtained from different sources of Pogostemon cablin.
PubMed: A hexane fraction of guava Leaves (Psidium guajava L.) induces anticancer activity by suppressing AKT/mammalian target of rapamycin/ribosomal p70 S6 kinase in human prostate cancer cells.
PubMed: [Constituents analysis on volatile oil of Pogostemon cablin from different collection time cultivated in Hainan].
PubMed: [GC-MS analysis of volatile oil of Herba Pogostemonis collected from Leizhou county].
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