Molecule ID: mol10734

SMILES: OC(c1cccc(Br)c1)C(F)(F)F

InChI: InChI=1S/C8H6BrF3O/c9-6-3-1-2-5(4-6)7(13)8(10,11)12/h1-4,7,13H

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.50 IUPAC digitized pKa 0 » -1
11.50 OCHEM 0 » -1
11.50 QSARToolbox 0 » -1
11.50 QSARToolbox 0 » -1
11.50 AttenGpKa training set 0 » -1
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Charge States and Microspecies Visualization