Molecule ID: mol31298

SMILES: OC(c1c(F)c(F)c(F)c(F)c1F)(C(F)(F)F)C(F)(F)F

InChI: InChI=1S/C9HF11O/c10-2-1(3(11)5(13)6(14)4(2)12)7(21,8(15,16)17)9(18,19)20/h21H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization