Base information
| Cat. No. | |
| CAS No. | 21109-27-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9ClN2 |
| Molecular Weight | 180.634 |
| Exact Mass | 180.045 |
| XLogP3 | 2.9803 |
| Mr | 50.9821 |
| PSA | 41.81 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | NCc1cc2c([nH]1)ccc(c2)Cl |
