bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile

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Names

[ CAS No. ]:
1017-93-2

[ Name ]:
bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile

[Synonym ]:
5.5.6.6-Tetracyan-bicyclo<2.2.2>oct-2-en
2,2,3,3-Tetracyano bicyclo <2,2,2> octen
5.5.6.6-Tetracyano-bicyclo<2.2.2>oct-2-en

Chemical & Physical Properties

[ Density]:
1.3g/cm3

[ Boiling Point ]:
540.7ºC at 760mmHg

[ Molecular Formula ]:
C12H8N4

[ Molecular Weight ]:
208.21900

[ Flash Point ]:
284.2ºC

[ Exact Mass ]:
208.07500

[ PSA ]:
95.16000

[ LogP ]:
1.64952

[ Vapour Pressure ]:
9.33E-12mmHg at 25°C

[ Index of Refraction ]:
1.579

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DT8046900
CHEMICAL NAME :
Bicyclo(2.2.2)oct-5-ene-2,2,3,3-tetracarbonitrile
CAS REGISTRY NUMBER :
1017-93-2
BEILSTEIN REFERENCE NO. :
2697839
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H8-N4
MOLECULAR WEIGHT :
208.24

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 :
56 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#07694

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • cyclohexa-1,3-diene
  • Tetracyanoethylene

DownStream

Related Compounds

  • 4-methylbicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile
  • Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile,7-(dichloromethyl)-7-methyl-8-methylene-5-phenyl-
  • bicyclo[2.2.2]oct-2-ene-2,7,7,8,8-pentacarbonitrile
  • Bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylicacid, 2,3-dimethyl ester
  • Bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylicacid, 2,3-dimethyl ester, (1R,2S,3R,4S)-rel-
  • Bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylicacid, (1R,2R,3R,4S)-rel-