Molecule ID: mol37558

SMILES: O=[N+]([O-])c1ccc([N+](=O)[O-])c(OS(=O)(=O)/C=C/c2ccc(O)cc2)c1

InChI: InChI=1S/C14H10N2O8S/c17-12-4-1-10(2-5-12)7-8-25(22,23)24-14-9-11(15(18)19)3-6-13(14)16(20)21/h1-9,17H/b8-7+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization