Molecule ID: mol33058

SMILES: CC(C#N)(C(=O)O)c1ccccc1

InChI: InChI=1S/C10H9NO2/c1-10(7-11,9(12)13)8-5-3-2-4-6-8/h2-6H,1H3,(H,12,13)

Experimental Macro pKa Values

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