Base information
| Cat. No. | |
| CAS No. | 1393550-72-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H4N2O2 |
| Molecular Weight | 160.13 |
| Exact Mass | 160.027 |
| XLogP3 | 0.57828 |
| Mr | 39.727 |
| PSA | 70.82 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=Cc1nc(C=O)cc(c1)C#N |
