(Nitromethyl)benzene
- Product Name(Nitromethyl)benzene
- CAS622-42-4
- MFC7H7NO2
- MW137.14
- EINECS
- MOL File622-42-4.mol
Chemical Properties
| Melting point | 80.7 °C(Solv: ethanol (64-17-5)) |
| Boiling point | 251.96°C (rough estimate) |
| Density | 1.1596 |
| refractive index | 1.5323 (estimate) |
| storage temp. | 2-8°C |
| pka | 6.93±0.10(Predicted) |
| form | oil |
| color | Red to brown |
| BRN | 1100252 |
| InChI | 1S/C7H7NO2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2 |
| InChIKey | VLZLOWPYUQHHCG-UHFFFAOYSA-N |
| SMILES | [N+](=O)([O-])Cc1ccccc1 |
| EPA Substance Registry System | .alpha.-Nitrotoluene (622-42-4) |
Safety Information
| Hazard Codes | T |
| Risk Statements | 20/21/22-36/37/38-25 |
| Safety Statements | 26-36/37/39-45 |
| RIDADR | UN 2811 6.1 / PGIII |
| WGK Germany | 3 |
| HazardClass | IRRITANT, TOXIC |
| HS Code | 29042020 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Oral |