Base information
| Cat. No. | |
| CAS No. | 69316-10-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H8ClNO2 |
| Molecular Weight | 209.629 |
| Exact Mass | 209.024 |
| XLogP3 | 2.44498 |
| Mr | 52.6945 |
| PSA | 50.09 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1C(=O)CC#N)Cl |
