Base information
| Cat. No. | |
| CAS No. | 231287-89-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H3BrN2O4 |
| Molecular Weight | 247.003 |
| Exact Mass | 245.928 |
| XLogP3 | 1.9737 |
| Mr | 47.7183 |
| PSA | 96.01 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Brc1nc(cc(c1)[N+](=O)[O-])C(=O)O |
