Base information
| Cat. No. | |
| CAS No. | 1082041-19-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H4BrN3O3 |
| Molecular Weight | 258.029 |
| Exact Mass | 256.944 |
| XLogP3 | 2.4624 |
| Mr | 54.6387 |
| PSA | 94.73 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Oc1cc2[nH]nc(c2c(c1)[N+](=O)[O-])Br |
