Molecule ID: mol37557

SMILES: O=C(/C=C/C=C/c1ccc(O)cc1)Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]

InChI: InChI=1S/C17H12N2O7/c20-14-8-5-12(6-9-14)3-1-2-4-17(21)26-16-10-7-13(18(22)23)11-15(16)19(24)25/h1-11,20H/b3-1+,4-2+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization