2,2-Diallylcyclohexanone

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Names

[ CAS No. ]:
5277-36-1

[ Name ]:
2,2-Diallylcyclohexanone

[Synonym ]:
2,2-diallyl-cyclohexan-1-one
Cyclohexanone,2,2-diallyl
2,2-Diallylcyclohexanone
2,2-Dwuallilocykloheksanon [Polish]
2,2-Dwuallilocykloheksanon

Chemical & Physical Properties

[ Density]:
0.892g/cm3

[ Boiling Point ]:
236.5ºC at 760 mmHg

[ Molecular Formula ]:
C12H18O

[ Molecular Weight ]:
178.27100

[ Flash Point ]:
89.3ºC

[ Exact Mass ]:
178.13600

[ PSA ]:
17.07000

[ LogP ]:
3.26810

[ Index of Refraction ]:
1.463

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GW1400600
CHEMICAL NAME :
Cyclohexanone, 2,2-diallyl-
CAS REGISTRY NUMBER :
5277-36-1
BEILSTEIN REFERENCE NO. :
2046177
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H18-O
MOLECULAR WEIGHT :
178.30
WISWESSER LINE NOTATION :
T6VTJ B2U1 B2U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1560 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DPHFAK Dissertationes Pharmaceuticae et Pharmacologicae. (Warsaw, Poland) V.18-24, 1966-72. For publisher information, see PJPPAA. Volume(issue)/page/year: 22,89,1970

Safety Information

[ HS Code ]:
2914299000

Synthetic Route

Click to get detail synthetic route

Customs

[ HS Code ]: 2914299000

[ Summary ]:
2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

Related Compounds

  • 2,2-diallylcyclohexanone
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  • tert-Butyl-DL-alanine
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