Molecule ID: mol854

SMILES: NCCO

InChI: InChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.81 IUPAC digitized pKa 1 » 0
8.93 IUPAC digitized pKa 1 » 0
8.94 IUPAC digitized pKa 1 » 0
9.07 IUPAC digitized pKa 1 » 0
9.11 IUPAC digitized pKa 1 » 0
9.21 IUPAC digitized pKa 1 » 0
9.21 IUPAC digitized pKa 1 » 0
9.35 IUPAC digitized pKa 1 » 0
9.36 IUPAC digitized pKa 1 » 0
9.40 IUPAC digitized pKa 1 » 0
9.45 IUPAC digitized pKa 1 » 0
9.47 AttenGpKa training set 1 » 0
9.48 IUPAC digitized pKa 1 » 0
9.49 IUPAC digitized pKa 1 » 0
9.49 OCHEM 1 » 0
9.50 IUPAC digitized pKa 1 » 0
9.50 Organic Oxygen Acids and Nitrogen Bases 1 » 0
9.50 IUPAC digitized pKa 1 » 0
9.50 IUPAC digitized pKa 1 » 0
9.50 IUPAC digitized pKa 1 » 0
9.50 OCHEM 1 » 0
9.50 OCHEM 1 » 0
9.50 QSARToolbox 1 » 0
9.50 QSARToolbox 1 » 0
9.51 OCHEM 1 » 0
9.51 Hunt 1 » 0
9.55 Datawarrior 1 » 0
9.55 OCHEM 1 » 0
9.56 IUPAC digitized pKa 1 » 0
9.56 IUPAC digitized pKa 1 » 0
9.58 IUPAC digitized pKa 1 » 0
9.65 IUPAC digitized pKa 1 » 0
9.66 IUPAC digitized pKa 1 » 0
9.80 IUPAC digitized pKa 1 » 0
9.81 IUPAC digitized pKa 1 » 0
9.97 IUPAC digitized pKa 1 » 0
9.97 IUPAC digitized pKa 1 » 0
10.13 IUPAC digitized pKa 1 » 0
10.14 IUPAC digitized pKa 1 » 0
10.31 IUPAC digitized pKa 1 » 0
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Charge States and Microspecies Visualization