Molecule ID: mol22401

SMILES: CCCS(=O)(=O)C(C)C(=O)O

InChI: InChI=1S/C6H12O4S/c1-3-4-11(9,10)5(2)6(7)8/h5H,3-4H2,1-2H3,(H,7,8)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.51 OCHEM 0 » -1
2.51 AttenGpKa training set 0 » -1
2.58 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization