Base information
| Cat. No. | |
| CAS No. | 107023-66-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9N3O2 |
| Molecular Weight | 191.187 |
| Exact Mass | 191.069 |
| XLogP3 | 2.07778 |
| Mr | 54.027 |
| PSA | 72.85 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CN(c1ccc(cc1)[N+](=O)[O-])CC#N |
