Molecule ID: mol32423

SMILES: CCCC=C(C)C(=O)O

InChI: InChI=1S/C7H12O2/c1-3-4-5-6(2)7(8)9/h5H,3-4H2,1-2H3,(H,8,9)

Experimental Macro pKa Values

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