Base information
| Cat. No. | |
| CAS No. | 1072944-22-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H7BBrNO2 |
| Molecular Weight | 215.84 |
| Exact Mass | 214.975 |
| XLogP3 | -0.1677 |
| Mr | 46.7286 |
| PSA | 53.35 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OB(c1ccc(nc1C)Br)O |
