di(Dodecanedioic-d20 Acid 1-Methyl Ester) Barium

• CAT Number: R044808
• CAS Number: NA
• Molecular Formula: C₂₆H₈D₄₀BaO₈
• Molecular Weight: 666.23
• Purity: ≥95%
• Synonyms: di(Dodecanedioic-d20 Acid) Monomethyl Ester Barium Salt; Methyl Hydrogen di(Dodecanedioate-d20) Barium Salt
• Storage: -20°C
• InChI: InChI=1S/C13H24O4.Ba/c1-17-13(16)11-9-7-5-3-2-4-6-8-10-12(14)15;/h2-11H2,1H3,(H,14,15);/i2D2,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2
• InChIKey: MFFWWGZHIIOIMD-OMOGWILLSA-N
• SMILES: [2H]C([2H])(C(=O)O)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)OC.[Ba]

di(Dodecanedioic-d20 Acid 1-Methyl Ester) Barium is a deuterium-labeled barium salt of a dodecanedioic acid derivative. This compound features two dodecanedioic acid units, each with a methyl ester group, and is deuterium-labeled at twenty positions. The deuterium labeling enhances its utility in mass spectrometry and nuclear magnetic resonance (NMR) spectroscopy by providing improved sensitivity and resolution. It is used in polymer chemistry and materials science for studying polymerization processes, analyzing polymer properties, and investigating the interactions between barium salts and organic esters. The labeled compound aids in precise characterization and validation of synthetic methods and material formulations.