Introduction：Basic information about CAS 16156-90-4|1-(2-Iodoethyl)-2-methyl-5-nitro-1H-imidazole, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1-(2-Iodoethyl)-2-methyl-5-nitro-1H-imidazole |
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| CAS Number | 16156-90-4 | Molecular Weight | 281.05100 |
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| Density | 2.03g/cm3 | Boiling Point | 395.1ºC at 760mmHg |
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| Molecular Formula | C6H8IN3O2 | Melting Point | / |
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| MSDS | / | Flash Point | 192.8ºC |
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Names
| Name | 1-(2-Iodoethyl)-2-methyl-5-nitro-1H-imidazole |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 2.03g/cm3 |
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| Boiling Point | 395.1ºC at 760mmHg |
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| Molecular Formula | C6H8IN3O2 |
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| Molecular Weight | 281.05100 |
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| Flash Point | 192.8ºC |
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| Exact Mass | 280.96600 |
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| PSA | 63.64000 |
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| LogP | 2.05790 |
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| Vapour Pressure | 4.29E-06mmHg at 25°C |
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| Index of Refraction | 1.689 |
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| InChIKey | ROXLQGHOPINWFU-UHFFFAOYSA-N |
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| SMILES | Cc1ncc([N+](=O)[O-])n1CCI |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- NI6350000
- CHEMICAL NAME :
- Imidazole, 1-(2-iodoethyl)-2-methyl-5-nitro-
- CAS REGISTRY NUMBER :
- 16156-90-4
- BEILSTEIN REFERENCE NO. :
- 0611687
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C6-H8-I-N3-O2
- MOLECULAR WEIGHT :
- 281.07
- WISWESSER LINE NOTATION :
- T5N CNJ A2I 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 :
- 320 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-iodoethyl)-2-methyl-5-nitroimidazole |
