Molecule ID: mol1926

SMILES: O=C(O)CBr

InChI: InChI=1S/C2H3BrO2/c3-1-2(4)5/h1H2,(H,4,5)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.82 QSARToolbox 0 » -1
2.84 OCHEM 0 » -1
2.84 Datawarrior 0 » -1
2.86 QSARToolbox 0 » -1
2.89 Organic Oxygen Acids and Nitrogen Bases 0 » -1
2.89 OCHEM 0 » -1
2.89 OCHEM 0 » -1
2.89 Hunt 0 » -1
2.89 OCHEM 0 » -1
2.89 OCHEM 0 » -1
2.89 OCHEM 0 » -1
2.89 QSARToolbox 0 » -1
2.90 OCHEM 0 » -1
2.90 OCHEM 0 » -1
2.90 OCHEM 0 » -1
2.90 Baltruschat ChEMBL 0 » -1
2.90 QSARToolbox 0 » -1
2.90 QSARToolbox 0 » -1
2.90 QSARToolbox 0 » -1
2.91 AttenGpKa training set 0 » -1
2.92 IUPAC digitized pKa 0 » -1
2.94 QSARToolbox 0 » -1
2.94 QSARToolbox 0 » -1
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Charge States and Microspecies Visualization