4-(4-Chlorophenyl)-1H-1,2,4-triazol-5(4H)-one
- Product Name4-(4-Chlorophenyl)-1H-1,2,4-triazol-5(4H)-one
- CAS5097-86-9
- MFC8H6ClN3O
- MW195.61
- EINECS
- MOL File5097-86-9.mol
Chemical Properties
| Melting point | 200 °C |
| Density | 1.49±0.1 g/cm3(Predicted) |
| pka | 9.05±0.20(Predicted) |
| InChI | InChI=1S/C8H6ClN3O/c9-6-1-3-7(4-2-6)12-5-10-11-8(12)13/h1-5H,(H,11,13) |
| InChIKey | PMXUOAFWKPAZIG-UHFFFAOYSA-N |
| SMILES | N1=CN(C2=CC=C(Cl)C=C2)C(=O)N1 |