Molecule ID: mol35005

SMILES: CC(C)(C(=O)O)[S+]([O-])CC(=O)O

InChI: InChI=1S/C6H10O5S/c1-6(2,5(9)10)12(11)3-4(7)8/h3H2,1-2H3,(H,7,8)(H,9,10)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.20 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization