Base information
| Cat. No. | |
| CAS No. | 1865223-60-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8ClN3O |
| Molecular Weight | 197.622 |
| Exact Mass | 197.036 |
| XLogP3 | 2.05498 |
| Mr | 49.0186 |
| PSA | 78.91 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NNC(=O)c1ccc(cc1)C#N.Cl |
