Molecule ID: mol21745
SMILES: O=C(O)c1ccc(F)c(F)c1F
InChI: InChI=1S/C7H3F3O2/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2H,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.30 | QSARToolbox | 0 » -1 |
| 3.30 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |