Molecule ID: mol30559

SMILES: CCc1ccc(C(C)C)c(O)c1

InChI: InChI=1S/C11H16O/c1-4-9-5-6-10(8(2)3)11(12)7-9/h5-8,12H,4H2,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization