Molecule ID: mol10971

SMILES: CC(Oc1ccc(Cl)cc1Cl)C(=O)O

InChI: InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.86 QSARToolbox 0 » -1
2.86 QSARToolbox 0 » -1
2.86 QSARToolbox 0 » -1
2.86 QSARToolbox 0 » -1
2.86 OCHEM 0 » -1
2.86 IUPAC digitized pKa 0 » -1
2.86 OCHEM 0 » -1
2.93 AttenGpKa training set 0 » -1
3.10 Organic Oxygen Acids and Nitrogen Bases 0 » -1
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Charge States and Microspecies Visualization