Molecule ID: mol35057

SMILES: CC(C)=C1C2C3C2(C(=O)O)C2C1C32C(=O)O

InChI: InChI=1S/C12H12O4/c1-3(2)4-5-7-11(5,9(13)14)8-6(4)12(7,8)10(15)16/h5-8H,1-2H3,(H,13,14)(H,15,16)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization