3-CHLOROBENZOYLACETONITRILE
- Product Name3-CHLOROBENZOYLACETONITRILE
- CAS21667-62-9
- MFC9H6ClNO
- MW179.6
- EINECS626-892-7
- MOL File21667-62-9.mol
Chemical Properties
| Melting point | 79-83 °C |
| Boiling point | 347.1±27.0 °C(Predicted) |
| Density | 1.257±0.06 g/cm3(Predicted) |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| form | powder to crystal |
| pka | 7.12±0.10(Predicted) |
| color | White to Light yellow to Light orange |
| BRN | 2414476 |
| InChI | InChI=1S/C9H6ClNO/c10-8-3-1-2-7(6-8)9(12)4-5-11/h1-3,6H,4H2 |
| InChIKey | IUDFNNHFARLIPF-UHFFFAOYSA-N |
| SMILES | C1(=CC=CC(Cl)=C1)C(=O)CC#N |
| CAS DataBase Reference | 21667-62-9(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi,Xn |
| Risk Statements | 36/37/38-20/21/22-22 |
| Safety Statements | 26-36/37/39-36/37 |
| RIDADR | 3276 |
| WGK Germany | 3 |
| Hazard Note | Harmful/Irritant |
| HazardClass | IRRITANT |
| PackingGroup | III |
| HS Code | 29269090 |
