Molecule ID: mol808

SMILES: CC[C@](CC(=O)OC)(C(=O)O)c1ccccc1

InChI: InChI=1S/C13H16O4/c1-3-13(12(15)16,9-11(14)17-2)10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3,(H,15,16)/t13-/m1/s1

Experimental Macro pKa Values

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