Molecule ID: mol35870

SMILES: CCOC(=O)/C=C1/C=C(O)C(=O)S1

InChI: InChI=1S/C8H8O4S/c1-2-12-7(10)4-5-3-6(9)8(11)13-5/h3-4,9H,2H2,1H3/b5-4-

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization