Molecule ID: mol807

SMILES: COC(=O)C[C@](C)(Cc1ccccc1)C(=O)O

InChI: InChI=1S/C13H16O4/c1-13(12(15)16,9-11(14)17-2)8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,15,16)/t13-/m0/s1

Experimental Macro pKa Values

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