Molecule ID: mol37138
SMILES: O=P(O)(O)C(F)(F)c1cccc(C(F)(F)P(=O)(O)O)n1
InChI: InChI=1S/C7H7F4NO6P2/c8-6(9,19(13,14)15)4-2-1-3-5(12-4)7(10,11)20(16,17)18/h1-3H,(H2,13,14,15)(H2,16,17,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.18 | QSARToolbox | -2 » -3 |
| 5.30 | QSARToolbox | -2 » -3 |