Molecule ID: mol10069

SMILES: O=C(O)c1c(O)cccc1Cl

InChI: InChI=1S/C7H5ClO3/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3,9H,(H,10,11)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.63 IUPAC digitized pKa 0 » -1
2.63 OCHEM 0 » -1
2.63 QSARToolbox 0 » -1
2.63 QSARToolbox 0 » -1
2.63 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization