Base information
| Cat. No. | |
| CAS No. | 80166-90-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7BrN2O2 |
| Molecular Weight | 243.057 |
| Exact Mass | 241.969 |
| XLogP3 | 2.9865 |
| Mr | 58.0567 |
| PSA | 57.85 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Brc1cc2CCNc2c(c1)[N+](=O)[O-] |
