Base information
| Cat. No. | |
| CAS No. | 60331-15-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6ClN3O3 |
| Molecular Weight | 203.583 |
| Exact Mass | 203.01 |
| XLogP3 | 1.8784 |
| Mr | 47.322 |
| PSA | 80.83 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1nc(C)nc(c1[N+](=O)[O-])Cl |
