1H-Benzimidazole,2-nitro-(9CI)

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Names

[ CAS No. ]:
5709-67-1

[ Name ]:
1H-Benzimidazole,2-nitro-(9CI)

[Synonym ]:
5-Pyrimidinecarboxylic acid, 4-(4-chlorophenyl)-1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-, 2-(ethylthio)ethyl ester
2-Nitro-benzimidazol
2-nitro-1H-benzoimidazole
Benzimidazole,2-nitro
2-Nitrobenzimidazole
2-(Ethylsulfanyl)ethyl 4-(4-chlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
1H-Benzimidazole,2-nitro
1H-Benzimidazole,2-nitro-(9CI)

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
564.2±50.0 °C at 760 mmHg

[ Melting Point ]:
261-262ºC (dec.)

[ Molecular Formula ]:
C17H21ClN2O3S

[ Molecular Weight ]:
368.878

[ Flash Point ]:
295.0±30.1 °C

[ Exact Mass ]:
368.096130

[ PSA ]:
74.50000

[ LogP ]:
3.53

[ Vapour Pressure ]:
0.0±1.5 mmHg at 25°C

[ Index of Refraction ]:
1.566

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DD9660000
CHEMICAL NAME :
Benzimidazole, 2-nitro-
CAS REGISTRY NUMBER :
5709-67-1
BEILSTEIN REFERENCE NO. :
0957723
LAST UPDATED :
199612
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C7-H5-N3-O2
MOLECULAR WEIGHT :
163.15
WISWESSER LINE NOTATION :
T56 BM DNJ CNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
330 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
595 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 :
100 nmol/plate
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 173,169,1986

Safety Information

[ HS Code ]:
2933990090

Precursor & DownStream

Precursor

DownStream

  • 2,3-Dihydro-1H-benzo[d]imidazo[1,2-a]imidazole
  • 1-N-Methyl-2-nitrobenzimidazole

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • 1H-Benzimidazole,2-methoxy-4-nitro-(9CI)
  • 1H-Benzimidazole,2-methoxy-6-nitro-(9CI)
  • 1H-Benzimidazole,2-methoxy-5-nitro-(9CI)
  • 1H-Benzimidazole,2-chloro-4-nitro-(9CI)
  • 1H-Benzimidazole,2-chloro-6-nitro-(9CI)
  • 1H-Benzimidazole-2-methanol,4-nitro-(9CI)
  • ethyl 1-[2-(3-chlorophenyl)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate
  • ethyl 1-[2-(2-methoxyphenyl)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate
  • ethyl 1-[2-hydroxy-2-(2-methoxyphenyl)ethyl]-1H-1,2,3-triazole-4-carboxylate
  • ethyl 1-[2-(3-chlorophenyl)-2-hydroxyethyl]-1H-1,2,3-triazole-4-carboxylate
  • 1-[(3-methyl-1H-pyrazol-5-yl)methyl]piperazine
  • ethyl 1-[2-(3-cyanophenyl)-2-hydroxyethyl]-1H-1,2,3-triazole-4-carboxylate
  • Methyl 4-oxo-6-(2-thienyl)-4,5-dihydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxylate
  • 4,5-dimethyl 1-[2-oxo-2-(thiophen-2-yl)ethyl]-1H-1,2,3-triazole-4,5-dicarboxylate
  • 2-(2,2,2-Trifluoro-1-hydroxyethyl)benzonitrile
  • {3-[(6-Chloropyrazin-2-yl)oxy]propyl}dimethylamine
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