Molecule ID: mol36646

SMILES: COCC(=O)/C=C(\O)COC

InChI: InChI=1S/C7H12O4/c1-10-4-6(8)3-7(9)5-11-2/h3,8H,4-5H2,1-2H3/b6-3-

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.60 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization