Base information
| Cat. No. | |
| CAS No. | 6017-21-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6N4 |
| Molecular Weight | 170.171 |
| Exact Mass | 170.059 |
| XLogP3 | 2.18606 |
| Mr | 45.934 |
| PSA | 72.3 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#CC(N=Nc1ccccc1)C#N |
