Inositol,1,2,3,4,5,6-hexakis-O-(2-cyanoethyl)- (9CI)

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Names

[ CAS No. ]:
3055-84-3

[ Name ]:
Inositol,1,2,3,4,5,6-hexakis-O-(2-cyanoethyl)- (9CI)

[Synonym ]:
Benzene-1,2,3,4,5,6-hexakis(3-oxypropanenitrile)
3,3',3'',3''',3'''',3'''''-[(Cyclohexane-1,2,3,4,5,6-hexayl)hexaoxy]hexapropionitrile
1,2,3,4,5,6-Hexakis(2-cyanoethoxy)-cyclohexane
Cyclohexane,1,2,3,4,5,6-hexakis(2-cyanoethoxy)
EINECS 221-277-6

Chemical & Physical Properties

[ Density]:
1.23g/cm3

[ Boiling Point ]:
829.8ºC at 760mmHg

[ Molecular Formula ]:
C24H30N6O6

[ Molecular Weight ]:
498.53200

[ Flash Point ]:
292.3ºC

[ Exact Mass ]:
498.22300

[ PSA ]:
198.12000

[ LogP ]:
1.79328

[ Index of Refraction ]:
1.51

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GV5000000
CHEMICAL NAME :
Cyclohexane, 1,2,3,4,5,6-hexakis(2-cyanoethoxy)-
CAS REGISTRY NUMBER :
3055-84-3
LAST UPDATED :
197901
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C24-H30-N6-O6
MOLECULAR WEIGHT :
498.60
WISWESSER LINE NOTATION :
L6TJ AO2CN BO2CN CO2CN DO2CN EO2CN FO2CN

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#02784

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • L-(−)-chiro-Inositol
  • Acrylonitrile

DownStream

Related Compounds

  • (3AR,7aS)-tert-butyl 1-cyclopentyl-3-methyl-2-oxohexahydro-1H-imidazo[4,5-c]pyridine-5(6H)-carboxylate
  • 6-Amino-5-(difluoromethyl)-2-methoxynicotinaldehyde
  • 2-Amino-3-bromo-6-(difluoromethyl)pyridin-4-ol
  • (3AS,7aR)-1-phenylhexahydro-1H-imidazo[4,5-c]pyridin-2(3H)-one
  • (3AS,7aR)-tert-butyl 1-cyclopentyl-2-oxohexahydro-1H-imidazo[4,5-c]pyridine-5(6H)-carboxylate
  • (3AS,7aR)-tert-butyl 1-methyl-2-oxo-3-(pyridin-3-yl)hexahydro-1H-imidazo[4,5-c]pyridine-5(6H)-carboxylate
  • (3AS,7aR)-tert-butyl 1-methyl-2-oxo-3-phenylhexahydro-1H-imidazo[4,5-c]pyridine-5(6H)-carboxylate
  • (3AS,7aR)-tert-butyl 1-methyl-2-oxohexahydro-1H-imidazo[4,5-c]pyridine-5(6H)-carboxylate
  • (3AS,7aR)-tert-butyl 3-methyl-2-oxo-1-propylhexahydro-1H-imidazo[4,5-c]pyridine-5(6H)-carboxylate
  • Indoline-2-carbonitrile
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