Introduction：Basic information about CAS 6058-57-7|1-(2-BROMO-ETHYL)-2-METHYL-5-NITRO-1H-IMIDAZOLE, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1-(2-BROMO-ETHYL)-2-METHYL-5-NITRO-1H-IMIDAZOLE |
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| CAS Number | 6058-57-7 | Molecular Weight | 234.05100 |
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| Density | 1.75 g/cm3 | Boiling Point | 379.4ºC at 760 mmHg |
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| Molecular Formula | C6H8BrN3O2 | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | 1-(2-bromoethyl)-2-methyl-5-nitroimidazole |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.75 g/cm3 |
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| Boiling Point | 379.4ºC at 760 mmHg |
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| Molecular Formula | C6H8BrN3O2 |
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| Molecular Weight | 234.05100 |
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| Exact Mass | 232.98000 |
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| PSA | 63.64000 |
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| LogP | 2.01780 |
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| Index of Refraction | 1.635 |
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| InChIKey | HCKPAAMFYJPGMI-UHFFFAOYSA-N |
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| SMILES | Cc1ncc([N+](=O)[O-])n1CCBr |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- NI3550000
- CHEMICAL NAME :
- Imidazole, 1-(2-bromoethyl)-2-methyl-5-nitro-
- CAS REGISTRY NUMBER :
- 6058-57-7
- BEILSTEIN REFERENCE NO. :
- 0611686
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C6-H8-Br-N3-O2
- MOLECULAR WEIGHT :
- 234.08
- WISWESSER LINE NOTATION :
- T5N CNJ A2E B1 ENW
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 730 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: 11,167,1968
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Safety Information
Customs
| HS Code | 2933290090 |
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| Summary | 2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 1-(2-bromo-ethyl)-2-methyl-5-nitro-1H-imidazole |
| Imidazole,1-(2-bromoethyl)-2-methyl-5-nitro |
| 1-(2-Bromo-ethyl)-2-methyl-5-nitro |
| 1-(2'-bromoethyl)-2-methyl-5-nitroimidazole |
