Base information
| Cat. No. | |
| CAS No. | 2221-00-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9N3 |
| Molecular Weight | 159.188 |
| Exact Mass | 159.08 |
| XLogP3 | 2.0357 |
| Mr | 47.9684 |
| PSA | 43.84 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Nc1ccc(cc1)n1cncc1 |
