Molecule ID: mol14271

SMILES: O=[N+]([O-])c1cc(Br)ccc1O

InChI: InChI=1S/C6H4BrNO3/c7-4-1-2-6(9)5(3-4)8(10)11/h1-3,9H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization