Base information
| Cat. No. | |
| CAS No. | 31656-49-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H6N2 |
| Molecular Weight | 178.189 |
| Exact Mass | 178.053 |
| XLogP3 | 2.58316 |
| Mr | 53.378 |
| PSA | 47.58 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc2c(c1)ccc(c2)C#N |
