Molecule ID: mol32853

SMILES: O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)cc(Cl)c1O

InChI: InChI=1S/C13H7Cl3N2O4/c14-6-3-8(12(19)10(16)4-6)13(20)17-11-2-1-7(18(21)22)5-9(11)15/h1-5,19H,(H,17,20)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
4.00 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization