Molecule ID: mol36266

SMILES: O=C(Nc1ccc([N+](=O)[O-])cc1)OCC(F)(F)F

InChI: InChI=1S/C9H7F3N2O4/c10-9(11,12)5-18-8(15)13-6-1-3-7(4-2-6)14(16)17/h1-4H,5H2,(H,13,15)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
12.00 QSARToolbox 0 » -1
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Charge States and Microspecies Visualization