cyclosativene, 22469-52-9

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CODE156198 CODE156198
Product(s):
22469-52-9 (+)-CYCLOSATIVENE 95%

CAS Number:	22469-52-9	3D/inchi
FDA UNII:	Search
Beilstein Number:	6791339
MDL:	MFCD00084734
XlogP3-AA:	4.90 (est)
Molecular Weight:	204.35628000
Formula:	C15 H24
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:

Appearance:	colorless to pale yellow clear liquid (est)
Assay:	98.00 to 100.00
Food Chemicals Codex Listed:	No
Boiling Point:	87.00 °C. @ 10.00 mm Hg
Boiling Point:	242.00 to 244.00 °C. @ 760.00 mm Hg
Vapor Pressure:	0.050000 mmHg @ 25.00 °C. (est)
Flash Point:	235.00 °F. TCC ( 112.78 °C. )
logP (o/w):	5.864 (est)
Shelf Life:	12.00 month(s) or longer if stored properly.
Storage:	refrigerate in tightly sealed containers.
Soluble in:
	alcohol
	water, 0.415 mg/L @ 25 °C (est)
Insoluble in:
	water

Organoleptic Properties:

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

Cosmetic Information:

None found

Suppliers:

BOC Sciences

For experimental / research use only.

(+)-CYCLOSATIVENE 95%

Sigma-Aldrich: Aldrich

For experimental / research use only.

(+)-Cyclosativene 99%

sds

Safety Information:

Preferred SDS: View

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 cyclosativene usage levels up to:
	not for fragrance use.

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

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 :519960

National Institute of Allergy and Infectious Diseases:Data

WGK Germany:3

References:

NIST Chemistry WebBook:	Search Inchi
Pubchem (cid):	519960
Pubchem (sid):	10514219
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):	Search
FooDB:	FDB004759
Typical G.C.
VCF-Online:	VCF Volatile Compounds in Food
ChemSpider:	View
Wikipedia:	View

Potential Blenders and core components note

None Found

Potential Uses:

None Found

Occurrence (nature, food, other):note

	allspice plant Search Trop Picture
	basil plant Search Trop Picture
	bay laurel leaf Search Trop Picture
	bois de rose leaf oil brazil @ 1.40-2.70% Data GC Search Trop Picture
	bois de rose oil brazil @ trace-0.90% Data GC Search Trop Picture
	cascarilla bark oil @ 0.53% Data GC Search Trop Picture
	corn leaf Search Trop Picture
	ginger Search Trop Picture
	labdanum leaf oil @ 0.70% Data GC Search Trop Picture
	mikania cordata (burm. f.) b.l. robinson var. cordata leaf oil france @ 0.60% Data GC Search Trop Picture
	persea americana mill. fruit oil cuba @ 1.40% Data GC Search Trop Picture
	phoebe oil brazil @ 0.33% Data GC Search Trop Picture
	safflower bud Search Trop Picture
	salvia plebeia oil @ 0.11% Data GC Search Trop Picture
	witch hazel leaf oil @ 0.07% Data GC Search Trop Picture
	xylopia aromatica (lam.) mart. leaf oil cuba @ 1.10% Data GC Search Trop Picture

Synonyms:

(+)-	cyclosativene
(1S-(1.alpha.,2.alpha., 3a.beta.,4.alpha.,5.alpha., 7a.beta.,8S*))-	octahydro-1,7a-dimethyl-5-(1-methyl ethyl)-1,2,4-metheno-1H-indene

Articles:

PubMed:Protective effects of cyclosativene on H2O 2-induced injury in cultured rat primary cerebral cortex cells.

PubMed:Hepatoprotection of sesquiterpenoids: a quantitative structure-activity relationship (QSAR) approach.

PubMed:Computational studies on biosynthetic carbocation rearrangements leading to sativene, cyclosativene, alpha-ylangene, and beta-ylangene.

PubMed:In situ volatile collection, analysis, and comparison of three Centaurea species and their relationship to biocontrol with herbivorous insects.

PubMed:Oxidation of cyclopropane terpenoids with ruthenium tetraoxide.

PubMed:Male lures for mediterranean fruitfly (Ceratitis capitata wied.): Structural analogs of α-copaene.

Notes:

None found

cyclosativene (1S-(1.alpha.,2.alpha., 3a.beta.,4.alpha.,5.alpha., 7a.beta.,8S*))-octahydro-1,7a-dimethyl-5-(1-methyl ethyl)-1,2,4-metheno-1H-indene

Supplier Sponsors

Articles:

cyclosativene
(1S-(1.alpha.,2.alpha., 3a.beta.,4.alpha.,5.alpha., 7a.beta.,8S*))-octahydro-1,7a-dimethyl-5-(1-methyl ethyl)-1,2,4-metheno-1H-indene