Molecule ID: mol30885

SMILES: Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl

InChI: InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.80 OCHEM 0 » -1
8.05 OCHEM 0 » -1
8.05 AttenGpKa training set 0 » -1
8.40 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization