Base information
| Cat. No. | |
| CAS No. | 3531-19-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H4ClN3O4 |
| Molecular Weight | 217.567 |
| Exact Mass | 216.989 |
| XLogP3 | 3.3662 |
| Mr | 53.5004 |
| PSA | 117.66 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1cc(Cl)c(c(c1)[N+](=O)[O-])N |
