Molecule ID: mol23468

SMILES: CC/C(=C\c1ccc(Cl)cc1)C(=O)O

InChI: InChI=1S/C11H11ClO2/c1-2-9(11(13)14)7-8-3-5-10(12)6-4-8/h3-7H,2H2,1H3,(H,13,14)/b9-7+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.92 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization