1,1,2,2-Cyclopropanetetracarbonitrile,3,3-dimethyl-

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Names

[ CAS No. ]:
13017-67-9

[ Name ]:
1,1,2,2-Cyclopropanetetracarbonitrile,3,3-dimethyl-

[Synonym ]:
3,3-dimethyl-1,1,2,2-tetracyanopropane
dimethyl-cyclopropane-1,1,2,2-tetracarbonitrile
Dimethyl-cyclopropan-1,1,2,2-tetracarbonitril
3,3-Dimethyl-1,1,2,2-tetracyanocyclopropan
2,2,3,3-tetracyano-1,1-dimethylcyclopropane
1,1,2,2-CYCLOPROPANETETRACARBONITRILE,3,3-DIMETHYL
1,1,2,2-tetracyano-3,3-dimethylcyclopropane

Chemical & Physical Properties

[ Density]:
1.25g/cm3

[ Boiling Point ]:
468.5ºC at 760mmHg

[ Molecular Formula ]:
C9H6N4

[ Molecular Weight ]:
170.17100

[ Flash Point ]:
249.5ºC

[ Exact Mass ]:
170.05900

[ PSA ]:
95.16000

[ LogP ]:
1.09332

[ Vapour Pressure ]:
5.96E-09mmHg at 25°C

[ Index of Refraction ]:
1.524

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GZ2220000
CHEMICAL NAME :
1,1,2,2-Cyclopropanetetracarbonitrile, 3,3-dimethyl-
CAS REGISTRY NUMBER :
13017-67-9
BEILSTEIN REFERENCE NO. :
2576343
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H6-N4
MOLECULAR WEIGHT :
170.19
WISWESSER LINE NOTATION :
L3TJ ACN ACN BCN BCN C1 C1

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 :
20 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#01734

Safety Information

[ HS Code ]:
2926909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • UNII:95GG0L5YGE
  • Malononitrile
  • 2-(2-methylpropylidene)propanedinitrile
  • Tetracyanoethylene
  • 2-Diazopropane
  • Acetone
  • Bromomalononitrile

DownStream

  • 5-(Aminocarbonyl)-6,6-dimethyl-2,4-dioxo-3-azabicyclo(3.1.0)hexane-1-carboxylic acid
  • 6,6-dimethyl-2,4-dioxo-3-azabicyclo[3.1.0]hexane-1,5-dicarboxylic acid
  • 6,6-dimethyl-2,4-dioxo-3-azabicyclo[3.1.0]hexane-1,5-dicarbonitrile
  • 4,4-DIMETHYL ITACONIC ACID

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

  • ethyl 5-(1H-imidazol-1-yl)-1H-indole-2-carboxylate
  • 4-(Benzofuran-2-yl)cyclohexanecarboxylic acid
  • (S)-(3-((6-(6-Methoxy-5-methylpyridin-3-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-yl)oxy)pyrrolidin-1-yl)(tetrahydro-2H-pyran-4-yl)methanone
  • 1-(4,5-Dihydro-1,2-oxazol-3-yl)-2-methylpropan-1-amine
  • N-tert-butyl-2-{[6-methyl-4-oxo-3-(propan-2-yl)-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
  • 4-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-phenylisoquinolin-1(2H)-one
  • 4-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methoxyphenyl)isoquinolin-1(2H)-one
  • 4-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methoxyphenyl)isoquinolin-1(2H)-one
  • 4-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methoxyphenyl)isoquinolin-1(2H)-one
  • 4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methoxyphenyl)isoquinolin-1(2H)-one
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