Base information
| Cat. No. | |
| CAS No. | 349136-53-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H16ClNO |
| Molecular Weight | 225.715 |
| Exact Mass | 225.092 |
| XLogP3 | 3.6493 |
| Mr | 63.6762 |
| PSA | 29.1 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 31 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCCC(NC(=O)c1ccccc1Cl)C |
