Propanedinitrile,2-[(5-nitro-2-furanyl)methylene]-

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Names

[ CAS No. ]:
69527-46-4

[ Name ]:
Propanedinitrile,2-[(5-nitro-2-furanyl)methylene]-

[Synonym ]:
5-Nitro-2-furfurylidenemalononitrile
5-Nitro-2-furfurylidenmalodinitril
5-nitrofurfurylidenemalonodinitrile
5-Nitrofufurylidenemalononitrile

Chemical & Physical Properties

[ Density]:
1.476g/cm3

[ Boiling Point ]:
356ºC at 760mmHg

[ Molecular Formula ]:
C8H3N3O3

[ Molecular Weight ]:
189.12800

[ Flash Point ]:
169.1ºC

[ Exact Mass ]:
189.01700

[ PSA ]:
106.54000

[ LogP ]:
2.14156

[ Index of Refraction ]:
1.624

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
OO4381000
CHEMICAL NAME :
Malononitrile, (5-nitrofurfurylidene)-
CAS REGISTRY NUMBER :
69527-46-4
BEILSTEIN REFERENCE NO. :
0162716
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C8-H3-N3-O3
MOLECULAR WEIGHT :
189.14
WISWESSER LINE NOTATION :
T5OJ BNW E1UYCN&CN

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 :
5600 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
900 nmol/L
REFERENCE :
CBINA8 Chemico-Biological Interactions. (Elsevier Scientific Pub. Ireland Ltd., POB 85, Limerick, Ireland) V.1- 1969- Volume(issue)/page/year: 53,145,1985

Synthetic Route

Precursor & DownStream

Precursor

  • Malononitrile
  • N-(5-nitrofurfurylidene)-2-nitroaniline
  • 5-Nitro-2-furaldehyde diacetate
  • 5-Nitrofuraldehyde
  • Propanedinitrile,2-(2-furanylmethylene)-
  • Furfural
  • nitric acid

DownStream


Related Compounds

  • Ethanol,2-[[(5-nitro-2-furanyl)methylene]oxidoamino]-
  • Hydrazinecarboximidamide,2-[(5-nitro-2-furanyl)methylene]-, hydrochloride (1:1)
  • Hydrazinecarboxylicacid, 2-[(5-nitro-2-furanyl)methylene]-, ethyl ester
  • 4-Pyridinecarboxylicacid, 2-[(5-nitro-2-furanyl)methylene]hydrazide
  • Acetic acid,2-[(5-nitro-2-furanyl)methylene]hydrazide
  • Benzoic acid,2-[[(5-nitro-2-furanyl)methylene]amino]-,2-[(5-nitro-2-furanyl)methylene]hydrazide