Molecule ID: mol10363

SMILES: O=P(O)(O)COc1ccc(Cl)cc1

InChI: InChI=1S/C7H8ClO4P/c8-6-1-3-7(4-2-6)12-5-13(9,10)11/h1-4H,5H2,(H2,9,10,11)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization