Molecule ID: mol9703

SMILES: Cn1c(=O)cc(C(=O)O)[nH]c1=O

InChI: InChI=1S/C6H6N2O4/c1-8-4(9)2-3(5(10)11)7-6(8)12/h2H,1H3,(H,7,12)(H,10,11)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.52 IUPAC digitized pKa -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization