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3-[1,3,3-tris(2-cyanoethyl)-2-oxo-cyclohexyl]propanenitrile

Names

[ CAS No. ]:
5883-05-6

[ Name ]:
3-[1,3,3-tris(2-cyanoethyl)-2-oxo-cyclohexyl]propanenitrile

[Synonym ]:
2-Oxo-1,3,3-cyclohexanetetrapropionitrile
2-oxo-cyclohexane-1,1,3,3-tetrapropionitrile
cyclohexanone-2,2,6,6-tetrapropionitrile
1,1,3,3-Cyclohexanetetrapropionitrile,2-oxo
EINECS 227-559-5
2,2,6,6-tetracyanoethyl cyclohexanone
2-Oxo-1,1,3,3-cyclohexanetetrapropionitrile

Chemical & Physical Properties

[ Density]:
1.071g/cm3

[ Boiling Point ]:
605.5ºC at 760 mmHg

[ Molecular Formula ]:
C18H22N4O

[ Molecular Weight ]:
310.39300

[ Flash Point ]:
320ºC

[ Exact Mass ]:
310.17900

[ PSA ]:
112.23000

[ LogP ]:
3.92732

[ Index of Refraction ]:
1.485

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GV7500000
CHEMICAL NAME :
1,1,3,3-Cyclohexanetetrapropionitrile, 2-oxo-
CAS REGISTRY NUMBER :
5883-05-6
BEILSTEIN REFERENCE NO. :
3063826
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H22-N4-O
MOLECULAR WEIGHT :
310.44
WISWESSER LINE NOTATION :
L6VTJ B2CN B2CN F2CN F2CN

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
180 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03874

Safety Information

[ HS Code ]:
2926909090

Synthetic Route

Precursor & DownStream

Customs

[ HS Code ]: 2926909090

[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%


Related Compounds