Molecule ID: mol31030

SMILES: O=S(=O)(c1cc(S(=O)(=O)C(F)(F)F)c(O)c(S(=O)(=O)C(F)(F)F)c1)C(F)(F)F

InChI: InChI=1S/C9H3F9O7S3/c10-7(11,12)26(20,21)3-1-4(27(22,23)8(13,14)15)6(19)5(2-3)28(24,25)9(16,17)18/h1-2,19H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-2.00 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization