Base information
| Cat. No. | |
| CAS No. | 89532-79-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H8N2O2 |
| Molecular Weight | 140.14 |
| Exact Mass | 140.059 |
| XLogP3 | -0.0225 |
| Mr | 34.6518 |
| PSA | 55.24 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OCc1ccc(nn1)OC |
