4-Methyl-5-nitroimidazole
- Product Name4-Methyl-5-nitroimidazole
- CAS14003-66-8
- CBNumberCB2460189
- MFC4H5N3O2
- MW127.1
- EINECS237-809-5
- MDL NumberMFCD01721395
- MOL File14003-66-8.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 249 °C (lit.) |
| Boiling point | 235.85°C (rough estimate) |
| Density | 1.4748 (rough estimate) |
| refractive index | 1.5000 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | DMSO (Sparingly), Methanol (Slightly, Sonicated) |
| form | Powder or Crystalline Powder |
| pka | 8.74±0.10(Predicted) |
| color | White to light brown |
| InChI | InChI=1S/C4H5N3O2/c1-3-4(7(8)9)6-2-5-3/h2H,1H3,(H,5,6) |
| InChIKey | WSYOWIMKNNMEMZ-UHFFFAOYSA-N |
| SMILES | C1NC([N+]([O-])=O)=C(C)N=1 |
| FDA UNII | 5PUL8BW840 |
| NIST Chemistry Reference | Imidazole, 4-methyl-5-nitro-(14003-66-8) |
| EPA Substance Registry System | 1H-Imidazole, 4-methyl-5-nitro- (14003-66-8) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| RTECS | NI7562000 |
| TSCA | TSCA listed |
| HS Code | 2933299090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
