Molecule ID: mol8708

SMILES: COc1cc(-c2ccc3ccc(O)cc3[o+]2)ccc1O

InChI: InChI=1S/C16H12O4/c1-19-16-8-11(3-6-13(16)18)14-7-4-10-2-5-12(17)9-15(10)20-14/h2-9H,1H3,(H-,17,18)/p+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.17 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization