Molecule ID: mol22260

SMILES: C/C=C(\Cl)CC(=O)O

InChI: InChI=1S/C5H7ClO2/c1-2-4(6)3-5(7)8/h2H,3H2,1H3,(H,7,8)/b4-2-

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.22 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization