Molecule ID: mol30706

SMILES: O=S(=O)(c1cccc(O)c1)C(F)(F)F

InChI: InChI=1S/C7H5F3O3S/c8-7(9,10)14(12,13)6-3-1-2-5(11)4-6/h1-4,11H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.87 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization