Molecule ID: mol11061

SMILES: O=S(O)CCCc1ccccc1

InChI: InChI=1S/C9H12O2S/c10-12(11)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,10,11)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization