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Diethyl 4-Ethoxyphenyl-(Ethyl-D5)Malonate CAS NO 1189708-84-6
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CAS No.:1189708-84-6
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
Diethyl 4-Ethoxyphenyl-(Ethyl-D5)Malonate is a high-purity, deuterium-labeled derivative of a malonate ester, serving as a critical advanced intermediate in pharmaceutical research and development. Its core value lies in its role as a stable isotope-labeled building block, enabling precise metabolic and pharmacokinetic studies for new drug candidates. This compound is essential for researchers and manufacturers in the pharmaceutical industry, particularly those developing active pharmaceutical ingredients (APIs) where deuterium incorporation is used to modify drug metabolism and improve therapeutic profiles.
Application
- Pharmaceutical Intermediate: A key deuterated synthon for the synthesis of novel Active Pharmaceutical Ingredients (APIs) targeting improved metabolic stability.
- Metabolic Tracer: Used in drug discovery and development as a stable isotope-labeled standard for mass spectrometry-based bioanalytical studies and pharmacokinetic (PK) profiling.
- Deuterium Chemistry: Serves as a specialized building block in medicinal chemistry for the strategic incorporation of deuterium atoms into lead compounds.
- Reference Standard: Employed as an analytical standard for quality control and method validation in the production of deuterated pharmaceuticals.
- Organic Synthesis Research: Utilized in academic and industrial R&D for exploring new synthetic pathways involving functionalized malonate esters.
Basic Information
| Product Name | Diethyl 4-Ethoxyphenyl-(Ethyl-D5)Malonate |
| CAS No. | 1189708-84-6 |
| Molecular Formula | C16H17D5O5 |
| Molecular Weight | 299.36 g/mol (approx.) |
| Synonyms | Diethyl (4-ethoxyphenyl)(1,1,2,2,2-pentadeuteroethyl)propanedioate; Diethyl (4-ethoxyphenyl)(ethyl-d5)malonate; (Ethyl-d5)Diethyl 4-ethoxyphenylmalonate; Propanedioic acid, (4-ethoxyphenyl)(1,1,2,2,2-pentadeuteroethyl)-, 1,3-diethyl ester; Deuterated Diethyl 4-Ethoxyphenylmalonate; Diethyl 4-Ethoxyphenyl-(Ethyl-d5)malonate |
| EINECS | Contact for details |
Quality Control
Our Diethyl 4-Ethoxyphenyl-(Ethyl-D5)Malonate is manufactured under strict quality systems to ensure high chemical and isotopic purity suitable for research and development applications. Each batch is supported by a comprehensive Certificate of Analysis (COA) detailing key parameters such as assay (by HPLC or NMR), deuterium enrichment, and impurity profile. We adhere to cGMP principles where applicable to support our clients' regulatory requirements.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (typically 15-25°C). This material is moisture-sensitive; keep the container tightly sealed in a dry environment.
Specification
| Item | Specification |
|---|---|
| Appearance | Colorless to pale yellow liquid |
| Identification (IR) | Conforms to structure |
| Purity (HPLC) | ≥ 98.0% |
| Deuterium Enrichment (NMR/MS) | ≥ 98 atom % D |
| Water Content (KF) | ≤ 0.5% |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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Each batch undergoes strict QC, accompanied by COA, MSDS, and full compliance with international standards.
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