Molecule ID: mol8728

SMILES: CCO

InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
14.97 QSARToolbox 0 » -1
15.26 QSARToolbox 0 » -1
15.44 QSARToolbox 0 » -1
15.50 QSARToolbox 0 » -1
15.54 Datawarrior 0 » -1
15.54 OCHEM 0 » -1
15.66 QSARToolbox 0 » -1
15.90 QSARToolbox 0 » -1
15.90 QSARToolbox 0 » -1
15.90 IUPAC digitized pKa 0 » -1
15.92 OCHEM 0 » -1
15.93 IUPAC digitized pKa 0 » -1
15.93 QSARToolbox 0 » -1
15.95 AttenGpKa training set 0 » -1
16.00 IUPAC digitized pKa 0 » -1
16.00 Baltruschat ChEMBL 0 » -1
16.00 QSARToolbox 0 » -1
16.29 QSARToolbox 0 » -1
16.85 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization