Molecule ID: mol11167

SMILES: O=S(=O)(O)c1cc(Cl)c2cccnc2c1O

InChI: InChI=1S/C9H6ClNO4S/c10-6-4-7(16(13,14)15)9(12)8-5(6)2-1-3-11-8/h1-4,12H,(H,13,14,15)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.29 IUPAC digitized pKa 0 » -1
3.87 IUPAC digitized pKa 0 » -1
6.57 IUPAC digitized pKa -1 » -2
8.46 IUPAC digitized pKa -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization