Molecule ID: mol23448

SMILES: C[N+](C)(C)c1ccc(/C=C\C(=O)O)cc1

InChI: InChI=1S/C12H15NO2/c1-13(2,3)11-7-4-10(5-8-11)6-9-12(14)15/h4-9H,1-3H3/p+1/b9-6-

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization