Molecule ID: mol10623

SMILES: CCc1c[n+]([O-])c(C(=O)O)cc1[N+](=O)[O-]

InChI: InChI=1S/C8H8N2O5/c1-2-5-4-9(13)7(8(11)12)3-6(5)10(14)15/h3-4H,2H2,1H3,(H,11,12)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization