Molecule ID: mol13509

SMILES: CC(C)=C(C#N)C(=O)O

InChI: InChI=1S/C6H7NO2/c1-4(2)5(3-7)6(8)9/h1-2H3,(H,8,9)

Experimental Macro pKa Values

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