Molecule ID: mol35144

SMILES: CCC(COCC(=O)O)(COCC(=O)O)COCC(=O)O

InChI: InChI=1S/C12H20O9/c1-2-12(6-19-3-9(13)14,7-20-4-10(15)16)8-21-5-11(17)18/h2-8H2,1H3,(H,13,14)(H,15,16)(H,17,18)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.29 QSARToolbox 0 » -1
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Charge States and Microspecies Visualization