Molecule ID: mol37996

SMILES: C[S+](C)c1c(Cl)cc(O)cc1Cl

InChI: InChI=1S/C8H8Cl2OS/c1-12(2)8-6(9)3-5(11)4-7(8)10/h3-4H,1-2H3/p+1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
5.41 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization