alpha-bourbonene
3a,6-dimethyl-1-(propan-2-yl)-1,2,3,3a,3b,4,6a,6b-octahydrocyclobuta[1,2-a:3,4-a']dicyclopentene
 
Notes:
None found
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CAS Number: 5208-58-2Picture of molecule3D/inchi
XlogP3-AA: 4.50 (est)
Molecular Weight: 204.35628000
Formula: C15 H24
NMR Predictor: Predict (works with chrome or firefox)
Category: flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 254.00 to  256.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.026000 mmHg @ 25.00 °C. (est)
Flash Point: 221.00 °F. TCC ( 105.00 °C. )
logP (o/w): 6.171 (est)
Soluble in:
 alcohol
 water, 0.3163 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: flavor and fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
 
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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 : 530816
National Institute of Allergy and Infectious Diseases: Data
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References:
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 530816
Pubchem (sid): 11079266
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): HMDB61850
FooDB: FDB005868
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
 bay laurel plant
Search Trop  Picture
 geranium
Search Trop  Picture
 oregano plant
Search Trop  Picture
 sideritis montana l. oil bulgaria @ 2.20%
Data  GC  Search Trop  Picture
 sideritis scardica l. oil bulgaria @ 0.70%
Data  GC  Search Trop  Picture
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Synonyms:
3-bourbonene
3a,6-dimethyl-1-(propan-2-yl)-1,2,3,3a,3b,4,6a,6b-octahydrocyclobuta[1,2-a:3,4-a']dicyclopentene
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Articles:
PubMed: Assessment of the chemical composition and in vitro antimicrobial potential of extracts of the liverwort Scapania aspera.
PubMed: A chemometrics as a powerful tool in the elucidation of the role of metals in the biosynthesis of volatile organic compounds in Hungarian thyme samples.
PubMed: Pachydictyols B and C: new diterpenes from Dictyota dichotoma Hudson.
PubMed: Variability of essential oils of Betonica officinalis (Lamiaceae) from different wild populations in Kosovo.
PubMed: Isoiridomyrmecin rich essential oil from Nepeta erecta Benth. and its antioxidant activity.
PubMed: The effect of temperature on the essential oil components of Salvia potentillifolia obtained by various methods.
PubMed: Composition of essential oils from leaves and flowers of Stachys germanica subsp. salviifolia (Ten.) gams (Labiatae) and related secretory structures.
PubMed: Identification of volatile components in Phyllanthus emblica L. and their antimicrobial activity.
PubMed: In situ seasonal study of the volatile production of almonds (Prunus dulcis) var. 'Nonpareil' and relationship to navel orangeworm.
PubMed: Chemical composition, antimicrobial and antioxidant activities of Centaurea ensiformis Hub.-Mor. (Asteraceae), a species endemic to Mugla (Turkey).
PubMed: Chemical composition and in vitro antimicrobial activity of the essential oils of two Helichrysum species from Tanzania.
PubMed: Antiectoparasitic activity of the gum resin, gum haggar, from the East African plant, Commiphora holtziana.
PubMed: Essential oil composition of Pimpinella anisum L. fruits from various European countries.
PubMed: [Gas chromatography for analysis of essential oils. Characteristics of essential oil of Dracocephalum species and the influence of extraction method on its composition].
PubMed: Analysis by gas chromatography-mass spectrometry of essential oil from seeds and aerial parts of Ferulago angulata (Schlecht.) Boiss gathered in Nevakoh and Shahoo, Zagross mountain, West of Iran.
PubMed: Comparison of different extraction methods for the analysis of volatile secondary metabolites of Lippia alba (Mill.) N.E. Brown, grown in Colombia, and evaluation of its in vitro antioxidant activity.
PubMed: Essential oil analysis of Eusteralis deccanensis Panigrahi (Lamiaceae).
PubMed: Chemical variability of the volatile metabolites from the Caribbean corals of the genus Gorgonia.
PubMed: [Sesquiterpene hydrocarbons from grapes (author's transl)].
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