Molecule ID: mol11529

SMILES: Cc1cc(O)c(C(C)C)cc1C

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

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.59 AttenGpKa training set 0 » -1
10.79 IUPAC digitized pKa 0 » -1
10.79 Datawarrior 0 » -1
10.79 OCHEM 0 » -1
10.79 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization