CAS 1139-30-6|Caryophyllene oxide

Introduction:Basic information about CAS 1139-30-6|Caryophyllene oxide, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameCaryophyllene oxide
CAS Number1139-30-6Molecular Weight220.350
Density1.0±0.1 g/cm3Boiling Point279.7±19.0 °C at 760 mmHg
Molecular FormulaC15H24OMelting Point62-63ºC(lit.)
MSDSChineseUSAFlash Point119.7±19.5 °C
Symbol
GHS07
Signal WordWarning

Names

Name(-)-Caryophyllene oxide
SynonymMore Synonyms

Caryophyllene oxide BiologicalActivity

DescriptionCaryophyllene oxide, isolated from from Annona squamosa L. bark., possesses analgesic and anti-inflammatory activity[1].
Related CatalogSignaling Pathways >>Others >>OthersResearch Areas >>Inflammation/Immunology
References

[1]. Chavan MJ, et al. Analgesic and anti-inflammatory activity of Caryophyllene oxide from Annona squamosa L. bark. Phytomedicine. 2010 Feb;17(2):149-51.

Chemical & Physical Properties

Density1.0±0.1 g/cm3
Boiling Point279.7±19.0 °C at 760 mmHg
Melting Point62-63ºC(lit.)
Molecular FormulaC15H24O
Molecular Weight220.350
Flash Point119.7±19.5 °C
Exact Mass220.182709
PSA12.53000
LogP4.57
Vapour Pressure0.0±0.6 mmHg at 25°C
Index of Refraction1.507
InChIKeyNVEQFIOZRFFVFW-RGCMKSIDSA-N
SMILESC=C1CCC2OC2(C)CCC2C1CC2(C)C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RP5530000
CHEMICAL NAME :
5-Oxatricyclo(8.2.0.0(sup 4,6))dodecane, 4,12,12-trimethyl-9-methylene-, (1R,4R,6R,10S)-
CAS REGISTRY NUMBER :
1139-30-6
LAST UPDATED :
199701
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C15-H24-O
MOLECULAR WEIGHT :
220.39

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 21,661,1983 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 21,661,1983
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 21,661,1983

Safety Information

Symbol
GHS07
Signal WordWarning
Hazard StatementsH315-H319
Precautionary StatementsP305 + P351 + P338
Personal Protective Equipmentdust mask type N95 (US);Eyeshields;Gloves
Hazard CodesXi
Risk PhrasesR36/38
Safety Phrases26
RIDADRNONH for all modes of transport
WGK Germany2
RTECSRP5530000
HS Code29109000

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Synonyms

(1R,4R,6R,10S)-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
(-)-b-Caryophyllene oxide
6,7-Epoxy-3(15)-caryophyllene
(−)-Caryophyllene oxide
4b,5a-Epoxycaryophyllene
(-)-b-Caryophyllene epoxide
(1R,4R,6R,10S)-4,12,12-Trimethyl-9-methylene-5-oxatricyclo[8.2.0.0]dodecane
(-)-Epoxydihydrocaryophyllene
(-)-caryophyllene oxide
5-Oxatricyclo(8.2.0.0(4,6))dodecane, 4,12,12-trimethyl-9-methylene-, (1R,4R,6R,10S)-
b-Caryophyllene oxide
Caryophyllene 4b,5a-oxide
β-Caryophyllene oxide
EINECS 214-519-7
MFCD00134216
b-Caryophyllene epoxide
trans-caryophyllene oxide
5-Oxatricyclo[8.2.0.0]dodecane, 4,12,12-trimethyl-9-methylene-, (1R,4R,6R,10S)-
caryophyllene oxide
(−)-Epoxycaryophyllene
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