Molecule ID: mol2003

SMILES: CC(C)(C)CO

InChI: InChI=1S/C5H12O/c1-5(2,3)4-6/h6H,4H2,1-3H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
15.50 AttenGpKa training set 0 » -1
16.04 OCHEM 0 » -1
16.04 Hunt 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization