Molecule ID: mol5773

SMILES: CN=C1CC(=O)C=CC1=O

InChI: InChI=1S/C7H7NO2/c1-8-6-4-5(9)2-3-7(6)10/h2-3H,4H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.90 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization