Base information
| Cat. No. | |
| CAS No. | 1211592-29-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H5BrN2O4 |
| Molecular Weight | 261.03 |
| Exact Mass | 259.943 |
| XLogP3 | 2.0621 |
| Mr | 52.0385 |
| PSA | 85.01 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cc(cnc1Br)[N+](=O)[O-] |
