Molecule ID: mol10587

SMILES: O=[N+]([O-])c1cccc(CC([N+](=O)[O-])[N+](=O)[O-])c1

InChI: InChI=1S/C8H7N3O6/c12-9(13)7-3-1-2-6(4-7)5-8(10(14)15)11(16)17/h1-4,8H,5H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization