Molecule ID: mol1841

SMILES: COC(=O)[C@](C)(CC(=O)O)c1ccc([N+](=O)[O-])cc1

InChI: InChI=1S/C12H13NO6/c1-12(7-10(14)15,11(16)19-2)8-3-5-9(6-4-8)13(17)18/h3-6H,7H2,1-2H3,(H,14,15)/t12-/m1/s1

Experimental Macro pKa Values

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