Base information
| Cat. No. | |
| CAS No. | 116954-73-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H9ClN4 |
| Molecular Weight | 172.615 |
| Exact Mass | 172.052 |
| XLogP3 | 1.8632 |
| Mr | 45.2678 |
| PSA | 74.79 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NNC(=N)c1ccncc1.Cl |
