Benzamide,N-[cyano(methylthio)methyl]-4-nitro-

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Names

[ CAS No. ]:
31666-17-8

[ Name ]:
Benzamide,N-[cyano(methylthio)methyl]-4-nitro-

Chemical & Physical Properties

[ Density]:
1.377g/cm3

[ Boiling Point ]:
472.1ºC at 760mmHg

[ Molecular Formula ]:
C10H9N3O3S

[ Molecular Weight ]:
251.26200

[ Flash Point ]:
239.3ºC

[ Exact Mass ]:
251.03600

[ PSA ]:
124.01000

[ LogP ]:
2.45138

[ Index of Refraction ]:
1.613

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CV2510000
CHEMICAL NAME :
Benzamide, N-(cyano(methylthio)methyl)-p-nitro-
CAS REGISTRY NUMBER :
31666-17-8
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H9-N3-O3-S
MOLECULAR WEIGHT :
251.28
WISWESSER LINE NOTATION :
WNR DVMYS1&CN

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 14,456,1971

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 5-Oxazolamine,4-(methylthio)-2-(4-nitrophenyl)-N-[(4-nitrophenyl)methylene]-

DownStream

Related Compounds

  • Benzamide,N-cyano-4-nitro-
  • Benzamide,N-methyl-4-nitro-
  • N-benzyl-N-[cyano-(4-nitrophenyl)methyl]-4-nitrobenzamide
  • N-[cyano(methylsulfanyl)methyl]benzamide
  • N-cyano-4-nitro-N-trimethylstannylbenzamide
  • N-methyl-4-nitro-N-nitrosobenzamide
  • N,N-dimethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
  • CID 119086004
  • 5-(Aminomethyl)-2-bromo-4-pyridinol
  • 5-(aminomethyl)-6-bromo-N,N-dimethylpyridin-3-amine
  • 2-Bromo-3-ethyl-4-pyridinemethanamine
  • [6-Bromo-5-(methoxymethyl)pyridin-3-yl]methanamine
  • 4-(Difluoromethyl)-5-fluoro-2-methylpyridine
  • 2-Aminooxazole-5-carbonitrile
  • 5-Pyrimidinethiol, 2-(trifluoromethyl)-
  • 2,6-dibromo-4-cyclopropylPyridine
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