Description

tert-Butyl Acetate-D12 is a deuterated isotopologue of tert-butyl acetate, where all twelve hydrogen atoms are replaced by deuterium. This high-purity labeled compound is essential for applications requiring precise analytical tracking and minimal spectral interference. It is primarily utilized by researchers and quality control laboratories in the pharmaceutical, agrochemical, and advanced materials sectors for use as an internal standard, solvent, or precursor in NMR spectroscopy and mass spectrometry.

Application

• Internal Standard for Analytical Chemistry: Used in quantitative GC-MS and LC-MS analyses to ensure accuracy and reproducibility in method development and validation.
• NMR Spectroscopy Solvent: Serves as a deuterated solvent for proton NMR, providing a clean background for structural elucidation of organic compounds.
• Metabolic and Pharmacokinetic Studies: Employed as a labeled tracer or precursor in drug metabolism and disposition research within pharmaceutical R&D.
• Polymer and Material Science Research: Acts as a specialty solvent or reagent in the synthesis and study of deuterated polymers and advanced materials.
• Environmental Fate Studies: Utilized in tracing the degradation pathways and environmental behavior of chemical compounds.
• Quality Control and Reference Standard: Provides a certified reference material for calibrating instruments and verifying analytical methods in regulated laboratories.

Basic Information

Product Name	tert-Butyl Acetate-D12
CAS No.	358731-05-2
Molecular Formula	C6D12O2
Molecular Weight	128.22 g/mol
Synonyms	Acetic-d3 Acid tert-Butyl-d9 Ester; tert-Butyl-d9 Acetate-d3; Perdeuterated tert-Butyl Acetate; 1,1-Dimethylethyl-d9 Acetate-d3; t-Butyl Acetate-D12; Deuterated TBAC; TBAC-d12; (CD3)3COOCD3
EINECS	Contact for details

Quality Control

Our tert-Butyl Acetate-D12 is manufactured under controlled conditions to ensure exceptional isotopic and chemical purity. Each batch is supported by a comprehensive Certificate of Analysis (COA) detailing specifications for isotopic enrichment (D atom %), chemical purity by GC, water content, and NMR conformity. We adhere to stringent quality management protocols to support research and development in regulated environments.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, well-ventilated area at room temperature (15-25°C). Due to its highly volatile nature, keep away from heat, sparks, and open flame. For long-term stability, consider storage under an inert atmosphere.

Specification

Item	Specification
Appearance	Clear, Colorless Liquid
Identification (IR)	Conforms
Isotopic Purity (D atom %)	≥ 99%
Chemical Purity (GC)	≥ 99.5%
Water Content (KF)	≤ 0.05%
NMR Conformity	Meets Requirements

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.