Base information
| Cat. No. | |
| CAS No. | 604001-03-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H5F3O3 |
| Molecular Weight | 218.129 |
| Exact Mass | 218.019 |
| XLogP3 | 2.2161 |
| Mr | 43.7908 |
| PSA | 54.37 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=Cc1cc(cc(c1)C(F)(F)F)C(=O)O |
