Base information
| Cat. No. | |
| CAS No. | 52709-86-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H15NO |
| Molecular Weight | 237.296 |
| Exact Mass | 237.115 |
| XLogP3 | 4.01408 |
| Mr | 72.699 |
| PSA | 33.02 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 34 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCCOc1ccc(cc1)c1ccc(cc1)C#N |
