Base information
| Cat. No. | |
| CAS No. | 1003711-16-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H9N3O3 |
| Molecular Weight | 183.165 |
| Exact Mass | 183.064 |
| XLogP3 | 1.9934 |
| Mr | 48.9214 |
| PSA | 93.96 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1cnc(c(c1C)[N+](=O)[O-])N |
