Base information
| Cat. No. | |
| CAS No. | 63572-67-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H8ClN3O |
| Molecular Weight | 233.654 |
| Exact Mass | 233.036 |
| XLogP3 | 1.97798 |
| Mr | 60.2257 |
| PSA | 69.54 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 25 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | ClCC(=O)C(c1nc2c([nH]1)cccc2)C#N |
