2-Methyl-5-nitroimidazole-1-ethanol (CAS 443-48-1) — formula C6H9N3O3, molecular weight 171.15; category organic chemicals.
2-Methyl-5-nitroimidazole-1-ethanol is a carbon-based organic compound with CAS registry number 443-48-1 and molecular formula C6H9N3O3 (molecular weight 171.15), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 443-48-1
Its molecular formula C6H9N3O3 comprises 6 C, 9 H, 3 N, 3 O atoms.
Also known as: 2-Methyl-5-nitroimidazole-1-ethanol · Metronidazole
Category: organic chemicals
The CAS registry number of 2-Methyl-5-nitroimidazole-1-ethanol is 443-48-1.
Molecular formula C6H9N3O3, molecular weight 171.15.
It is also registered under: 2-Methyl-5-nitroimidazole-1-ethanol, Metronidazole.
Category: Organic Chemicals.
Public-database records for 2-Methyl-5-nitroimidazole-1-ethanol (CAS 443-48-1), reproduced here for independent cross-checking.
| GHS notification summary | 1.1% (2 / 177) |
|---|---|
| Reported hazard statements | H302 (15.3%), H312 (16.4%), H332 (16.9%), H341 (53.7%), H350 (49.7%), H351 (34.5%), H373 (29.4%), H412 (39.5%) |
This chemical does not meet GHS hazard criteria for 1.1% (2 of 177) of reports.
H302 (15.3%): Harmful if swallowed [Warning Acute toxicity, oral]
| Regulatory & Food Contact | ANTIPROTOZOAL_AGENT: Veterinary Drug FLAGYL ADI NOT EVALUATED Relevant toxicological data were unavailable for the Committee's evaluation. TRS 788-JECFA 34/27 |
|---|---|
| GHS notification summary | 1.1% (2 / 177) |
| 沸点 | 405.4 |
|---|---|
| 熔点 | 316 to 320 °F (NTP, 1992) |
| 熔点 | 160 |
| 熔点 | 158-160 °C |
| 熔点 | 160 °C |
| 溶解度 | In water, 11,000 mg/L at 25 °C |
| 溶解度 | 5.92e+00 g/L |
| LogP | -0.02 |
| LogP | log Kow = -0.02 |
| LogP | -0.1 |
| CAS Registry Number | 443-48-1 |
|---|---|
| PubChem CID | 4173 |
| 分子式 | C6H9N3O3 |
| IUPAC 名称 | 2-(2-methyl-5-nitroimidazol-1-yl)ethanol |
| UNII(FDA) | 140QMO216E |
metronidazole; 443-48-1; Metronidazol; Gineflavir; 2-Methyl-5-nitroimidazole-1-ethanol; Deflamon; Orvagil; Trichazol; MetroGel; Sanatrichom; Anagiardil; Danizol; Meronidal; Metronidaz; Mexibol; Trichocide
| 分子量 | 171.15 |
|---|---|
| XLogP3 | 0 |
| 氢键供体数 | 1 |
| 氢键受体数 | 4 |
| 可旋转键数 | 2 |
| 精确质量 | 171.06439116 |
| 单同位素质量 | 171.06439116 |
| 拓扑极性表面积 | 83.9 |
| 重原子数 | 12 |
| 形式电荷 | 0 |
2-Methyl-5-nitroimidazole-1-ethanol · CAS 443-48-1 · C6H9N3O3. UNII 140QMO216E. 沸点: 405.4; 熔点: 316 to 320 °F (NTP, 1992); 熔点: 160.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.