Base information
| Cat. No. | |
| CAS No. | 85-66-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H10N2O |
| Molecular Weight | 210.231 |
| Exact Mass | 210.079 |
| XLogP3 | 2.0383 |
| Mr | 63.887 |
| PSA | 34.89 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 28 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cn1c2ccccc2nc2-c1cccc2=O |
