Molecule ID: mol31363

SMILES: CCC(C)(CC(C)C)OO

InChI: InChI=1S/C8H18O2/c1-5-8(4,10-9)6-7(2)3/h7,9H,5-6H2,1-4H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization