Molecule ID: mol32848

SMILES: CC(C)(C)c1cc(C=C(C#N)S(C)(=O)=O)cc(C(C)(C)C)c1O

InChI: InChI=1S/C18H25NO3S/c1-17(2,3)14-9-12(8-13(11-19)23(7,21)22)10-15(16(14)20)18(4,5)6/h8-10,20H,1-7H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.77 OCHEM 0 » -1
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Charge States and Microspecies Visualization