Base information
| Cat. No. | |
| CAS No. | 381679-24-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6BrN3O3 |
| Molecular Weight | 260.045 |
| Exact Mass | 258.959 |
| XLogP3 | 2.3069 |
| Mr | 55.0717 |
| PSA | 87.81 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CC(=O)Nc1ncc(cc1[N+](=O)[O-])Br |
