Base information
| Cat. No. | |
| CAS No. | 556112-92-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6F4O2 |
| Molecular Weight | 222.136 |
| Exact Mass | 222.03 |
| XLogP3 | 2.6311 |
| Mr | 42.6815 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cc(ccc1F)C(F)(F)F |
