Molecule ID: mol38549

SMILES: O=C(O)C1CC(C(=O)O)CC(C(=O)O)C1

InChI: InChI=1S/C9H12O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h4-6H,1-3H2,(H,10,11)(H,12,13)(H,14,15)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization