Base information
| Cat. No. | |
| CAS No. | 107229-61-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11ClN2O |
| Molecular Weight | 234.682 |
| Exact Mass | 234.056 |
| XLogP3 | 3.4774 |
| Mr | 64.6304 |
| PSA | 48.14 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Clc1ccccc1COc1cccnc1N |
