Base information
| Cat. No. | |
| CAS No. | 69447-84-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H11BrN2O2 |
| Molecular Weight | 247.089 |
| Exact Mass | 246 |
| XLogP3 | 3.2776 |
| Mr | 57.7834 |
| PSA | 71.84 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | NCCc1ccc(cc1)[N+](=O)[O-].Br |
