Molecule ID: mol12529

SMILES: C=C(SC1CCCCC1)C(=O)O

InChI: InChI=1S/C9H14O2S/c1-7(9(10)11)12-8-5-3-2-4-6-8/h8H,1-6H2,(H,10,11)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.40 Datawarrior 0 » -1
3.40 QSARToolbox 0 » -1
3.40 OCHEM 0 » -1
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Charge States and Microspecies Visualization