Molecule ID: mol17800

SMILES: CCOC(=O)Nc1cc(Cl)ccc1O

InChI: InChI=1S/C9H10ClNO3/c1-2-14-9(13)11-7-5-6(10)3-4-8(7)12/h3-5,12H,2H2,1H3,(H,11,13)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
16.00 OCHEM -1 » -2
16.00 Baltruschat ChEMBL -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization