Base information
| Cat. No. | |
| CAS No. | 20331-29-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H18ClNO |
| Molecular Weight | 239.741 |
| Exact Mass | 239.108 |
| XLogP3 | 3.8405 |
| Mr | 69.7447 |
| PSA | 29.1 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 34 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | ClCCC(=O)Nc1ccc(cc1)C(CC)C |
