Base information
| Cat. No. | |
| CAS No. | 85333-43-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6ClN3 |
| Molecular Weight | 167.596 |
| Exact Mass | 167.025 |
| XLogP3 | 1.6911 |
| Mr | 42.963 |
| PSA | 30.19 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 18 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cc1cn2c(n1)c(Cl)ncc2 |
