Molecule ID: mol31308

SMILES: OC1(C(F)(F)F)C2OC3OC1C(O)(C(F)(F)F)C(O3)C2(O)C(F)(F)F

InChI: InChI=1S/C10H7F9O6/c11-8(12,13)5(20)1-6(21,9(14,15)16)3-7(22,10(17,18)19)2(5)24-4(23-1)25-3/h1-4,20-22H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization