Molecule ID: mol35966

SMILES: O=C(O)C(C(C(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI: InChI=1S/C4H6O10S2/c5-3(6)1(15(9,10)11)2(4(7)8)16(12,13)14/h1-2H,(H,5,6)(H,7,8)(H,9,10,11)(H,12,13,14)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
4.83 QSARToolbox -3 » -4
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization