4-(Methylsulfonyl)benzonitrile
- Product Name4-(Methylsulfonyl)benzonitrile
- CAS22821-76-7
- MFC8H7NO2S
- MW181.21
- EINECS
- MOL File22821-76-7.mol
Chemical Properties
| Melting point | 137-142 °C |
| Boiling point | 385.8±34.0 °C(Predicted) |
| Density | 1.3055 (rough estimate) |
| refractive index | 1.5650 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| form | Crystalline Powder |
| color | White to orange to brown |
| InChI | 1S/C8H7NO2S/c1-12(10,11)8-4-2-7(6-9)3-5-8/h2-5H,1H3 |
| InChIKey | FARXIDYHJAANGP-UHFFFAOYSA-N |
| SMILES | CS(=O)(=O)c1ccc(cc1)C#N |
| CAS DataBase Reference | 22821-76-7(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xn,Xi |
| Risk Statements | 20/21/22-22 |
| Safety Statements | 24/25 |
| WGK Germany | WGK 3 |
| Hazard Note | Irritant |
| HS Code | 29214200 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |
