Base information
| Cat. No. | |
| CAS No. | 152803-05-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H4N2 |
| Molecular Weight | 128.131 |
| Exact Mass | 128.037 |
| XLogP3 | 0.93458 |
| Mr | 36.887 |
| PSA | 36.68 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | C#Cc1cncc(c1)C#N |
