bulnesol, 22451-73-6

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Name:	2-(3,8-dimethyl-1,2,3,3a,4,5,6,7-octahydroazulen-5-yl)propan-2-ol
CAS Number:	22451-73-6	3D/inchi
FDA UNII:	Search
Nikkaji Web:	J133.567G
XlogP3-AA:	2.90 (est)
Molecular Weight:	222.37142000
Formula:	C15 H26 O
NMR Predictor:	Predict (works with chrome, Edge 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

Physical Properties:

Assay:	96.00 to 100.00
Food Chemicals Codex Listed:	No
Specific Gravity:	0.93890 @ 70.00 °C.
Refractive Index:	1.48915 @ 70.00 °C.
Melting Point:	69.00 to 70.00 °C. @ 760.00 mm Hg
Boiling Point:	136.00 to 138.00 °C. @ 760.00 mm Hg
Flash Point:	240.00 °F. TCC ( 115.56 °C. )
logP (o/w):	4.771 (est)
Soluble in:
	alcohol
	water, 7.074 mg/L @ 25 °C (est)
Insoluble in:
	water

Organoleptic Properties:

Odor Type: spicy

spicy

Odor Description:at 100.00 %. spicy

Odor and/or flavor descriptions from others (if found).

Cosmetic Information:

None found

Suppliers:

None found

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

Safety in Use Information:

Category:
natural substances and extractives
Recommendation for bulnesol usage levels up to:
	not for fragrance use.

Recommendation for bulnesol flavor usage levels up to:
	not for flavor use.

Safety References:

EPI System: View

AIDS Citations:Search

Cancer Citations:Search

Toxicology Citations:Search

EPA Substance Registry Services (TSCA):22451-73-6

EPA ACToR:Toxicology Data

EPA Substance Registry Services (SRS):Registry

Laboratory Chemical Safety Summary :90785

National Institute of Allergy and Infectious Diseases:Data

2-(3,8-dimethyl-1,2,3,3a,4,5,6,7-octahydroazulen-5-yl)propan-2-ol

Chemidplus:0022451736

References:

	2-(3,8-dimethyl-1,2,3,3a,4,5,6,7-octahydroazulen-5-yl)propan-2-ol
NIST Chemistry WebBook:	Search Inchi
Canada Domestic Sub. List:	22451-73-6
Pubchem (cid):	90785
Pubchem (sid):	135049251
Flavornet:	22451-73-6
Pherobase:	View

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):	HMDB36445
FooDB:	FDB015332
Export Tariff Code:	3302.90.0010
Typical G.C.
VCF-Online:	VCF Volatile Compounds in Food
ChemSpider:	View
Wikipedia:	View

Potential Blenders and core components note

None Found

Potential Uses:

woody

Occurrence (nature, food, other):note

	bulnesis sarmienti lor. Search Trop Picture
	cajuput oil vietnam @ trace% Data GC Search Trop Picture
	callitris columellaris wood oil australia @ 0.90% Data GC Search Trop Picture
	callitris glaucophylla wood oil australia @ 0.60% Data GC Search Trop Picture
	callitris intratropica wood oil australia @ 0.60% Data GC Search Trop Picture
	camel grass oil @ 0.30% Data GC Search Trop Picture
	cassinia laevis flower oil australia @ 0.40% Data GC Search Trop Picture
	cassinia laevis leaf oil australia @ 0.90% Data GC Search Trop Picture
	guaiacwood oil Search Trop Picture
	guaiacwood oil @ 40.54% Data GC Search Trop Picture
	helichrysum italicum oil america @ 0.81% Data GC Search Trop Picture
	piper cernum vell. var. cernum yuncker leaf oil brazil @ 0.20% Data GC Search Trop Picture

Synonyms:

5-	azulenemethanol, 1,2,3,3a,4,5,6,7-octahydro-a,a,3,8-tetramethyl-, (3S,3aS,5R)-
	bulensol
2-(3,8-	dimethyl-1,2,3,3a,4,5,6,7-octahydroazulen-5-yl)propan-2-ol
	guai-1(10)-en-11-ol
(3S-(3alpha, 3abeta,5alpha))- alpha,alpha,3,8-	tetramethyl-1,2,3,3a,4,5,6,7-octahydro-5-azulene methanol
(3S,3aS,5R)- alpha,alpha,3,8-	tetramethyl-1,2,3,3a,4,5,6,7-octahydro-5-azulene methanol

Articles:

PubMed:Constituents of essential oils from the leaves, stem barks and resins of Canarium parvum Leen., and Canarium tramdenanum Dai et Yakovl. (Burseracea) grown in Vietnam.

PubMed:Essential oil of flowers of Anaphalis contorta, an aromatic and medicinal plant from India.

PubMed:4,5-seco-guaiane and a nine-membered sesquiterpene lactone from Holostylis reniformis.

PubMed:Antifungal Activity of the Essential Oils of Callitris neocaledonica and C. sulcata Heartwood (Cupressaceae).

PubMed:Chemical analysis and biological activity of the essential oils of two endemic Soqotri Commiphora species.

PubMed:Constituents of the essential oil from aerial parts of Chromolaena odorata from Thailand.

PubMed:Aroma compound analysis of Piper nigrum and Piper guineense essential oils from Cameroon using solid-phase microextraction-gas chromatography, solid-phase microextraction-gas chromatography-mass spectrometry and olfactometry.

PubMed:Composition and antimicrobial activity of the essential oil of Cistus creticus subsp. eriocephalus.

Notes:

Constit. of guaiac wood oil (Bulnesia sarmienti). Also from Ferula spp.

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