Base information
| Cat. No. | |
| CAS No. | 101333-98-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8N2O |
| Molecular Weight | 148.162 |
| Exact Mass | 148.064 |
| XLogP3 | 1.9868 |
| Mr | 41.6824 |
| PSA | 52.05 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | NCc1nc2c(o1)cccc2 |
