Base information
| Cat. No. | |
| CAS No. | 1040375-79-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H8N2O |
| Molecular Weight | 172.183 |
| Exact Mass | 172.064 |
| XLogP3 | 1.7401 |
| Mr | 53.2549 |
| PSA | 44.89 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 23 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1NCc2c1c1ccccc1[nH]2 |
