Introduction：Basic information about CAS 27896-84-0|5-Nitro-1H-3,1-benzimidazol-1-ium nitrate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 5-Nitro-1H-3,1-benzimidazol-1-ium nitrate |
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| CAS Number | 27896-84-0 | Molecular Weight | 226.146 |
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| Density | / | Boiling Point | 475.7ºC at 760 mmHg |
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| Molecular Formula | C7H6N4O5 | Melting Point | 220-222 °C(lit.) |
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| MSDS | / | Flash Point | 241.5ºC |
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Names
| Name | nitric acid,6-nitro-1H-benzimidazole |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Boiling Point | 475.7ºC at 760 mmHg |
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| Melting Point | 220-222 °C(lit.) |
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| Molecular Formula | C7H6N4O5 |
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| Molecular Weight | 226.146 |
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| Flash Point | 241.5ºC |
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| Exact Mass | 226.033813 |
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| PSA | 140.55000 |
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| LogP | 2.16980 |
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| Vapour Pressure | 9.35E-09mmHg at 25°C |
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| InChIKey | ZUZQXHSOEZUAIS-UHFFFAOYSA-N |
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| SMILES | O=[N+]([O-])O.O=[N+]([O-])c1ccc2nc[nH]c2c1 |
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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 DATAACUTE 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
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Safety Information
| Hazard Codes | Xi:Irritant; |
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| Risk Phrases | R36/37/38 |
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| Safety Phrases | S26 |
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| WGK Germany | 3 |
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| RTECS | DD9801000 |
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| HS Code | 2933990090 |
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Customs
| HS Code | 2933990090 |
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| 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% |
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Synonyms
| 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 |
