Base information
| Cat. No. | |
| CAS No. | 27472-21-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H15NO2 |
| Molecular Weight | 205.253 |
| Exact Mass | 205.11 |
| XLogP3 | 2.55008 |
| Mr | 58.562 |
| PSA | 42.25 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 30 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCOc1cc(CC#N)ccc1OCC |
