Molecule ID: mol6068

SMILES: NC1(F)C=C(F)C(F)=C(F)C1F

InChI: InChI=1S/C6H4F5N/c7-2-1-6(11,12)5(10)4(9)3(2)8/h1,5H,12H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-0.28 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization