Base information
| Cat. No. | |
| CAS No. | 71411-93-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H13NO2 |
| Molecular Weight | 191.226 |
| Exact Mass | 191.095 |
| XLogP3 | 2.35568 |
| Mr | 53.755 |
| PSA | 42.25 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCOc1cccc(c1C#N)OCC |
