Base information
| Cat. No. | |
| CAS No. | 84586-28-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H7N3O |
| Molecular Weight | 173.171 |
| Exact Mass | 173.059 |
| XLogP3 | 0.8319 |
| Mr | 48.0887 |
| PSA | 58.64 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=c1cnc(n[nH]1)c1ccccc1 |
