Base information
| Cat. No. | |
| CAS No. | 52471-07-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H4ClN3 |
| Molecular Weight | 153.569 |
| Exact Mass | 153.009 |
| XLogP3 | 1.77008 |
| Mr | 38.3664 |
| PSA | 62.7 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Nc1nc(Cl)ccc1C#N |
