Molecule ID: mol12089

SMILES: CCOC(=O)C(C(=O)OCC)c1nccc2ccccc12

InChI: InChI=1S/C16H17NO4/c1-3-20-15(18)13(16(19)21-4-2)14-12-8-6-5-7-11(12)9-10-17-14/h5-10,13H,3-4H2,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
5.50 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization