Resolution of carboxylate protonation microequilibria of NTA, EDTA and related complexones

Talanta. 2008 Jan 15;74(4):666-74. doi: 10.1016/j.talanta.2007.06.035. Epub 2007 Jul 1.

Abstract

Potentiometric and NMR-pH titrations were carried out on four classical complexones to elucidate their overall and site-specific basicities. NMR-pH profiles and Bjerrum's functions were adjusted to compound-specific symmetries and appropriate evaluation methods were developed. Symmetry-modulated relationships between the macro- and microconstants were deduced and self-consistent sets of microconstants were determined. The inherent basicity of carboxylates surrounded by adjacent, intramolecular ammonium and carboxylate sites have been found to be in the range of 1.83-2.02logk units, which are reduced by 0.05-0.12logk units upon a nearby carboxylate protonation.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Carboxylic Acids / chemistry*
  • Edetic Acid / chemistry*
  • Hydrogen-Ion Concentration
  • Magnetic Resonance Spectroscopy
  • Protons*

Substances

  • Carboxylic Acids
  • Protons
  • Edetic Acid