Molecule ID: mol10249

SMILES: CCOC(=O)CSC(C)C(=O)O

InChI: InChI=1S/C7H12O4S/c1-3-11-6(8)4-12-5(2)7(9)10/h5H,3-4H2,1-2H3,(H,9,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization