Molecule ID: mol8989

SMILES: CCCO

InChI: InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
15.10 QSARToolbox 0 » -1
15.10 QSARToolbox 0 » -1
15.35 QSARToolbox 0 » -1
15.35 QSARToolbox 0 » -1
15.40 QSARToolbox 0 » -1
15.75 QSARToolbox 0 » -1
15.75 QSARToolbox 0 » -1
15.97 Datawarrior 0 » -1
15.97 OCHEM 0 » -1
16.10 IUPAC digitized pKa 0 » -1
16.10 OCHEM 0 » -1
16.10 AttenGpKa training set 0 » -1
16.10 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization