Base information
| Cat. No. | |
| CAS No. | 71648-45-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6ClF3O |
| Molecular Weight | 222.592 |
| Exact Mass | 222.006 |
| XLogP3 | 3.5614 |
| Mr | 46.6485 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(=O)c1cc(ccc1Cl)C(F)(F)F |
