Molecule ID: mol12247

SMILES: O=c1cc2oc3cc(O)c(O)cc3c(-c3ccccc3O)c-2cc1O

InChI: InChI=1S/C19H12O6/c20-12-4-2-1-3-9(12)19-10-5-13(21)15(23)7-17(10)25-18-8-16(24)14(22)6-11(18)19/h1-8,20-23H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.51 IUPAC digitized pKa 0 » -1
6.25 IUPAC digitized pKa -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization