Molecule ID: mol38581

SMILES: C[N+](C)(C)C(Cc1ccc(O)cc1)C(=O)[O-]

InChI: InChI=1S/C12H17NO3/c1-13(2,3)11(12(15)16)8-9-4-6-10(14)7-5-9/h4-7,11H,8H2,1-3H3,(H-,14,15,16)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
1.50 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization