Molecule ID: mol15136

SMILES: OC(CBr)(Oc1ccccc1)c1ccccc1

InChI: InChI=1S/C14H13BrO2/c15-11-14(16,12-7-3-1-4-8-12)17-13-9-5-2-6-10-13/h1-10,16H,11H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization