Molecule ID: mol778

SMILES: CCc1cc(C(C)C)c(O)cc1C

InChI: InChI=1S/C12H18O/c1-5-10-7-11(8(2)3)12(13)6-9(10)4/h6-8,13H,5H2,1-4H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
10.01 Hunt 0 » -1
10.91 Datawarrior 0 » -1
10.91 OCHEM 0 » -1
10.91 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization