Base information
| Cat. No. | |
| CAS No. | 853577-50-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H5ClN2O |
| Molecular Weight | 168.58 |
| Exact Mass | 168.009 |
| XLogP3 | 1.3072 |
| Mr | 44.2032 |
| PSA | 41.99 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 17 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1NCc2c1c(Cl)ncc2 |
