Molecule ID: mol5631

SMILES: O=C1C=C(O)C(=O)C=C1O

InChI: InChI=1S/C6H4O4/c7-3-1-4(8)6(10)2-5(3)9/h1-2,7,10H

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.73 QSARToolbox 0 » -1
2.73 QSARToolbox 0 » -1
5.18 QSARToolbox -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization