Molecule ID: mol5923

SMILES: NCC(Cl)=C(Cl)C(Cl)=C(Cl)Cl

InChI: InChI=1S/C5H4Cl5N/c6-2(1-11)3(7)4(8)5(9)10/h1,11H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
6.78 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization