Description

5-[2-[2-(1,1,2,2,3,3,4,4,4-Nonadeuteriobutoxy)Ethoxy]Ethoxymethyl]-6-Propyl-1,3-Benzodioxole is a deuterated derivative of a benzodioxole compound, specifically designed for advanced research and analytical applications. This high-purity compound is valued for its role as a stable isotope-labeled internal standard, critical for ensuring accuracy and reliability in quantitative mass spectrometry. It is primarily utilized by analytical chemists and researchers in the pharmaceutical, agrochemical, and environmental testing industries who require precise measurement of trace compounds. The product is supplied with a CAS number of 1329834-53-8.

Application

• Internal Standard for LC-MS/MS: Serves as a critical, non-interfering reference for the quantitative analysis of its non-deuterated counterpart in complex biological matrices like plasma, urine, and tissue homogenates.
• Pharmacokinetic and Metabolite Studies: Enables accurate tracking of drug absorption, distribution, metabolism, and excretion (ADME) in preclinical and clinical research.
• Environmental Fate Analysis: Used in trace-level detection and quantification of specific pollutants or agrochemicals in water, soil, and plant samples.
• Forensic Toxicology: Provides a reliable standard for the confirmatory analysis of specific controlled substances or their metabolites in forensic investigations.
• Method Development and Validation: Essential for developing, optimizing, and validating robust, regulatory-compliant analytical methods (e.g., following FDA or EMA guidelines).
• Isotope Dilution Mass Spectrometry (IDMS): Employed in this gold-standard technique to achieve the highest possible accuracy and precision in quantitative measurements.

Basic Information

Item	Details
Product Name	5-[2-[2-(1,1,2,2,3,3,4,4,4-Nonadeuteriobutoxy)Ethoxy]Ethoxymethyl]-6-Propyl-1,3-Benzodioxole
CAS No.	1329834-53-8
Molecular Formula	C19H19D9O5
Molecular Weight	~359.52 g/mol
Synonyms	6-Propyl-5-[(2-{2-[(1,1,2,2,3,3,4,4,4-nonadeuteriobutyl)oxy]ethoxy}ethoxy)methyl]-1,3-benzodioxole; Deuterated Benzodioxole Derivative; D9-5-[2-[2-(Butoxy)Ethoxy]Ethoxymethyl]-6-Propyl-1,3-Benzodioxole; 6-Propylpiperonyl butoxide-d9 (related analog); PB-d9 (common abbreviation); Isotopically Labeled Internal Standard for LC-MS; 1,3-Benzodioxole, 5-[[2-[2-[(1,1,2,2,3,3,4,4,4-nonadeuterio-1-oxobutoxy)ethoxy]ethoxy]methyl]-6-propyl-
EINECS	Contact for details

Quality Control

This deuterated standard is manufactured under strict quality control to ensure isotopic purity and chemical integrity, which are paramount for analytical accuracy. Each batch is characterized using advanced techniques including NMR (¹H, ¹³C, ²H), high-resolution mass spectrometry (HRMS), and HPLC. A comprehensive Certificate of Analysis (COA) is provided, detailing the isotopic enrichment (typically >98 atom % D), chemical purity (by HPLC), and confirming identity and structure. Our quality system is designed to support GMP/GLP-compliant research.

Storage

Preserve in a tightly closed container, protected from light. Store at -20°C or below for long-term stability. This product is hygroscopic (moisture-sensitive); allow the sealed vial to equilibrate to room temperature before opening to minimize moisture ingress. For extended storage, consider under an inert atmosphere.

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid or oil
Identification (NMR)	Conforms to structure
Identification (MS)	Conforms to structure
Isotopic Purity (Atom % D)	≥98% (by ²H NMR or MS)
Chemical Purity (HPLC)	≥95%
Water Content (KF)	≤0.5%
Solubility	Soluble in common organic solvents (methanol, acetonitrile, DMSO)

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