4-(1H-1,3-Benzodiazol-2-yl)benzonitrile
- Product Name4-(1H-1,3-Benzodiazol-2-yl)benzonitrile
- CAS4110-15-0
- MFC14H9N3
- MW219.24
- EINECS
- MOL File4110-15-0.mol
Chemical Properties
| Melting point | 230-234 °C |
| Boiling point | 467.8±47.0 °C(Predicted) |
| Density | 1.31±0.1 g/cm3(Predicted) |
| pka | 10.96±0.10(Predicted) |
| form | solid |
| InChI | 1S/C14H9N3/c15-9-10-5-7-11(8-6-10)14-16-12-3-1-2-4-13(12)17-14/h1-8H,(H,16,17) |
| InChIKey | INIBMZLOCLDDMA-UHFFFAOYSA-N |
| SMILES | N#CC(C=C1)=CC=C1C2=NC3=CC=CC=C3N2 |
Safety Information
| WGK Germany | WGK 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Dam. 1 |