Base information
| Cat. No. | |
| CAS No. | 636581-61-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7BrN2O4 |
| Molecular Weight | 275.056 |
| Exact Mass | 273.959 |
| XLogP3 | 2.8305 |
| Mr | 58.6479 |
| PSA | 98.14 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cc(Br)cc(c1N)[N+](=O)[O-] |
