Base information
| Cat. No. | |
| CAS No. | 2826-28-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11N3 |
| Molecular Weight | 197.236 |
| Exact Mass | 197.095 |
| XLogP3 | 2.18316 |
| Mr | 59.852 |
| PSA | 50.82 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CN(c1ccc(cc1)C=C(C#N)C#N)C |
