Base information
| Cat. No. | |
| CAS No. | 6701-17-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H19NO2 |
| Molecular Weight | 209.285 |
| Exact Mass | 209.142 |
| XLogP3 | 2.96988 |
| Mr | 60.358 |
| PSA | 50.09 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 33 |
| Ring number | 0 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | CCCCCCCCOC(=O)C(=C)C#N |
