Base information
| Cat. No. | |
| CAS No. | 835-58-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H5F3O4 |
| Molecular Weight | 234.129 |
| Exact Mass | 234.014 |
| XLogP3 | 2.1018 |
| Mr | 45.3626 |
| PSA | 74.6 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cc(ccc1C(=O)O)C(F)(F)F |
