Base information
| Cat. No. | |
| CAS No. | 1153949-98-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6N2 |
| Molecular Weight | 118.136 |
| Exact Mass | 118.053 |
| XLogP3 | 1.36996 |
| Mr | 32.673 |
| PSA | 47.58 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 15 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#C/C=C/1\CC(C1)C#N |
