Molecule ID: mol15995

SMILES: CCC(CO)NCl

InChI: InChI=1S/C4H10ClNO/c1-2-4(3-7)6-5/h4,6-7H,2-3H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
1.55 QSARToolbox 1 » 0
1.55 Datawarrior 1 » 0
1.55 OCHEM 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization