Molecule ID: mol9138

SMILES: OCCCCO

InChI: InChI=1S/C4H10O2/c5-3-1-2-4-6/h5-6H,1-4H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
14.50 QSARToolbox 0 » -1
15.10 IUPAC digitized pKa -1 » -2
15.10 AttenGpKa training set -1 » -2
15.40 OCHEM -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization