(1-Methyl-5-Nitro-1H-Imidazol-2-Yl)Methanol 1-甲基-5-硝基-2-羟甲基咪唑
CAS 936-05-0 MFCD00159675
化学结构图
SMILES: Cn1c([N+](=O)[O-])cnc1CO
化学属性
| Mol. Formula | C5H7N3O3 |
|---|---|
| Mol. Weight | 157.13 |
| Density | 1.54 |
| Melting Point | 115-116°C |
| Boiling Point | 422.2°C at 760 mmHg |
别名和识别编码
| Chemical Name | (1-Methyl-5-Nitro-1H-Imidazol-2-Yl)Methanol |
|---|---|
| Synonym | HMMNI {LY} HMMNI {} {LY} HMMNI {} {} {LY} HMMNI {} {} {} {LY} HMMNI {} {} {} {} {LY} HMMNI {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} HMMNI {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { |
| MDL Number | MFCD00159675 |
| PubChem Substance ID | 557356 |
| EC Number | 213-312-9 |
| CAS Number | 936-05-0 |
| Chemical Name Translation | 1-甲基-5-硝基-2-羟甲基咪唑 |
| Reaxys-RN | 744944 |
| InChIKey | WXSSUDRHAJTESR-UHFFFAOYSA-N |
| Wiswesser Line Notation | T5N CNJ A1 B1Q ENW |
| Beilstein Registry Number | 0744944 |
| LabNetwork Molecule ID | LN00314406 |
| InChI | InChI=1S/C5H7N3O3/c1-7-4(3-9)6-2-5(7)8(10)11/h2,9H,3H2,1H3 |
| Canonical SMILES | OCC1=NC=C([N+]([O-])=O)N1C |
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分类
- {SNA} Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, H, HA -HT
- {SNA} Analytical Standards, Antibiotics Standards, Pharmaceuticals, Illicit Drugs & Alcohol, 分析/色谱
相关文献及参考
- [1]. Cronly M, et al. Rapid confirmatory method for the determination of 11 nitroimidazoles in egg using liquid chromatography tandem mass spectrometry. J Chromatogr A. 2009;1216(46):8101‐8109.
安全信息
TYPE OF TEST : Mutation in microorganisms TEST SYSTEM : Bacteria - Salmonella typhimurium DOSE/DURATION : 112 umol/L REFERENCE : TCMUD8 Teratogenesis, Carcinogenesis, and Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.1- 1980- Volume(issue)/page/year: 3,51,1983
TYPE OF TEST : Mutation in microorganisms TEST SYSTEM : Bacteria - Klebsiella pneumoniae DOSE/DURATION : 10 umol/L/20H REFERENCE : MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 66,207,1979
