Base information
| Cat. No. | |
| CAS No. | 157654-67-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H22ClNO |
| Molecular Weight | 339.858 |
| Exact Mass | 339.139 |
| XLogP3 | 5.0735 |
| Mr | 107.073 |
| PSA | 29.1 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 47 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=C1/C(=C/c2ccc(cc2)C)/CNC/C/1=C\c1ccc(cc1)C.Cl |
