Base information
| Cat. No. | |
| CAS No. | 62737-71-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6N2O |
| Molecular Weight | 158.157 |
| Exact Mass | 158.048 |
| XLogP3 | 2.10026 |
| Mr | 42.718 |
| PSA | 60.72 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#CC(=C(c1ccco1)C)C#N |
