Base information
| Cat. No. | |
| CAS No. | 162401-59-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8F2O4 |
| Molecular Weight | 218.154 |
| Exact Mass | 218.039 |
| XLogP3 | 1.9948 |
| Mr | 46.4873 |
| PSA | 55.76 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1OC(F)F)C(=O)O |
