Base information
| Cat. No. | |
| CAS No. | 13138-53-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7N3O4 |
| Molecular Weight | 209.159 |
| Exact Mass | 209.044 |
| XLogP3 | 1.7164 |
| Mr | 51.4538 |
| PSA | 132 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | NC(=O)c1cc(ccc1C(=O)N)[N+](=O)[O-] |
