Base information
| Cat. No. | |
| CAS No. | 648423-79-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8N2O2 |
| Molecular Weight | 164.161 |
| Exact Mass | 164.059 |
| XLogP3 | 1.0522 |
| Mr | 41.4573 |
| PSA | 63.08 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cnc(nc1)C1CC1 |
