Molecule ID: mol37137

SMILES: O=P(O)(O)C(F)(F)c1ccc(C(F)(F)P(=O)(O)O)cc1

InChI: InChI=1S/C8H8F4O6P2/c9-7(10,19(13,14)15)5-1-2-6(4-3-5)8(11,12)20(16,17)18/h1-4H,(H2,13,14,15)(H2,16,17,18)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
4.82 QSARToolbox -2 » -3
5.60 QSARToolbox -2 » -3
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization