5-Nitro-1H-3,1-benzimidazol-1-ium nitrate

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Names

[ CAS No. ]:
27896-84-0

[ Name ]:
5-Nitro-1H-3,1-benzimidazol-1-ium nitrate

[Synonym ]:
Benzimidazole,5-nitro-,mononitrate
5-Nitro-1H-benzo[d]imidazole nitrate
6-Nitrobenzimidazole nitrate
5-Nitrobenzimidazole Nitrate
5-Nitrobenzimidazolium nitrate
1H-Benzimidazole, 5-nitro-, nitrate (1:1)
1H-Benzimidazole,5-nitro-,mononitrate
5-Nitro-1H-3,1-benzimidazol-1-ium nitrate
EINECS 248-716-4
MFCD00013157

Chemical & Physical Properties

[ Boiling Point ]:
475.7ºC at 760 mmHg

[ Melting Point ]:
220-222 °C(lit.)

[ Molecular Formula ]:
C7H6N4O5

[ Molecular Weight ]:
226.146

[ Flash Point ]:
241.5ºC

[ Exact Mass ]:
226.033813

[ PSA ]:
140.55000

[ LogP ]:
2.16980

[ Vapour Pressure ]:
9.35E-09mmHg at 25°C

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DD9801000
CHEMICAL NAME :
Benzimidazole, 5-nitro-, mononitrate
CAS REGISTRY NUMBER :
27896-84-0
LAST UPDATED :
199706
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C7-H5-N3-O2.H-N-O3

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>1600 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
KODAK* Kodak Company Reports. (343 State St., Rochester, NY 14650) Volume(issue)/page/year: 21MAY1971

Safety Information

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26

[ WGK Germany ]:
3

[ RTECS ]:
DD9801000

[ HS Code ]:
2933990090

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

  • alpha-(3-(1,1-Dimethylethyl)-2-hydroxyphenyl)-1-methyl-5-nitro-1H-imidazole-2-methanol
  • 1-Methyl-3-[1-(1-methyl-5-nitro-1H-imidazol-2-yl)-meth-(E)-ylidene]-piperidin-2-one
  • 1-methyl 2-(1-methyl 4-phenyl azetidin-2-one 3-ylidenemethyl) 5-nitroimidazole (Z)
  • 5-NITROISATOIC ANHYDRIDE
  • 1-hydroxy-2-methyl-6-nitro-benzoimidazole
  • 5,6-dimethyl-3-(1-methyl-5-nitro-1H-imidazol-2-ylmethylsulfanyl)-[1,2,4]triazine
  • 2-(Ethylamino)-N-methylpropanamide hydrochloride
  • 2-Ethyl-3H-isoindol-1-imine;hydrochloride
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 3-(2-Methyl-1,3-thiazol-5-yl)propanal
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 4-({1-[(5-Methyl-1,2-oxazol-4-yl)methyl]azetidin-3-yl}oxy)pyridine
  • Phenylmethyl 3-[[(1,1-dimethylethoxy)carbonyl]amino]-3-ethyl-1-piperidinecarboxylate
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • 5-(Chlorocarbonyl)-2,3-dihydro-1H-indole-1-carboxylic acid 1,1-dimethylethyl ester