Base information
| Cat. No. | |
| CAS No. | 52768-23-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12BrNO2 |
| Molecular Weight | 246.101 |
| Exact Mass | 245.005 |
| XLogP3 | 2.0304 |
| Mr | 59.8687 |
| PSA | 52.49 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Oc1cc2CNCCc2cc1O.Br |
