5-Nitrobenzimidazole
Names
[ CAS No. ]:
94-52-0
[ Name ]:
5-Nitrobenzimidazole
[Synonym ]:
5-Nitrobenzimidazole
EINECS 202-341-2
6-nitro-benzimidazol
5-nitro-benzimidazol
5-Nrtiobenzimidazole
1H-Benzimidazole, 6-nitro-
5-Nitro-1H-benzimidazole
6-Nitrobenzimidazole
6-nitrobenzimdazole
MFCD00005604
Benzimidazole,5-nitro
5-nitrobenzoimidazole
Chemical & Physical Properties
[ Density]:
1.5±0.1 g/cm3
[ Boiling Point ]:
475.7±18.0 °C at 760 mmHg
[ Melting Point ]:
207-210 °C
[ Molecular Formula ]:
C7H5N3O2
[ Molecular Weight ]:
163.133
[ Flash Point ]:
241.5±21.2 °C
[ Exact Mass ]:
163.038177
[ PSA ]:
74.50000
[ LogP ]:
1.64
[ Vapour Pressure ]:
0.0±1.1 mmHg at 25°C
[ Index of Refraction ]:
1.741
[ Stability ]:
Stable. Combustible. Incompatible with strong oxidizing agents, strong bases.
[ Water Solubility ]:
<0.01 g/100 mL at 16.5 ºC
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DD9800000
- CHEMICAL NAME :
- Benzimidazole, 6-nitro-
- CAS REGISTRY NUMBER :
- 94-52-0
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 8
- MOLECULAR FORMULA :
- C7-H5-N3-O2
- MOLECULAR WEIGHT :
- 163.15
- WISWESSER LINE NOTATION :
- T56 BM DNJ HNW
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 160 gm/kg/78W-C
- TOXIC EFFECTS :
- Tumorigenic - Carcinogenic by RTECS criteria Liver - tumors
- TYPE OF TEST :
- TD - Toxic dose (other than lowest)
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 79 gm/kg/78W-C
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria Liver - tumors
MUTATION DATA
- TYPE OF TEST :
- Mutation in microorganisms
- TEST SYSTEM :
- Bacteria - Salmonella typhimurium
- DOSE/DURATION :
- 33 ug/plate
- REFERENCE :
- ENMUDM Environmental Mutagenesis. (New York, NY) V.1-9, 1979-87. For publisher information, see EMMUEG. Volume(issue)/page/year: 8(Suppl 7),1,1986 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X1627 No. of Facilities: 302 (estimated) No. of Industries: 8 No. of Occupations: 13 No. of Employees: 4272 (estimated) No. of Female Employees: 1988 (estimated)
Safety Information
[ Hazard Codes ]:
Xn:Harmful;
[ Risk Phrases ]:
R22;R40
[ Safety Phrases ]:
S26-S45-S36/37
[ RIDADR ]:
2811
[ WGK Germany ]:
3
[ RTECS ]:
DD9800000
[ HS Code ]:
29339990
Synthetic Route
Precursor & DownStream
Precursor
DownStream
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%