Description

4-[4-(4-Chloro-2,3,5,6-Tetradeuteriophenyl)-4-Hydroxypiperidin-1-Yl]-1-(3-Ethyl-4-Fluorophenyl)Butan-1-One CAS NO 1794883-80-9 is a high-purity, deuterium-labeled organic compound designed for advanced research and development. This compound is critical for applications requiring precise isotopic labeling, such as internal standards for mass spectrometry and metabolic pathway studies. It is primarily utilized by pharmaceutical, agrochemical, and analytical chemistry laboratories engaged in drug discovery, metabolite identification, and pharmacokinetic research.

Application

• As a deuterated internal standard for the accurate quantification of its non-labeled counterpart in LC-MS/MS and GC-MS analysis.
• In pharmaceutical research for drug metabolism and pharmacokinetics (DMPK) studies to track and quantify metabolites.
• For mechanistic studies in medicinal chemistry, leveraging deuterium isotope effects to investigate reaction pathways.
• Use in agrochemical development for tracing the environmental fate and metabolic breakdown of active ingredients.
• As a key chemical reference standard in quality control laboratories to ensure analytical method validity.
• In academic research involving isotopically labeled probes for biological and chemical investigations.

Basic Information

Product Name	4-[4-(4-Chloro-2,3,5,6-Tetradeuteriophenyl)-4-Hydroxypiperidin-1-Yl]-1-(3-Ethyl-4-Fluorophenyl)Butan-1-One
CAS No.	1794883-80-9
Molecular Formula	C23H22D4ClFNO2
Molecular Weight	409.93 g/mol (approx.)
Synonyms	1-(3-Ethyl-4-fluorophenyl)-4-[4-(4-chloro-2,3,5,6-tetradeuteriophenyl)-4-hydroxypiperidin-1-yl]butan-1-one; 4-[4-(4-Chloro-2,3,5,6-tetradeuteriophenyl)-4-hydroxypiperidin-1-yl]-1-(3-ethyl-4-fluorophenyl)butan-1-one; Deuterated Haloperidol Metabolite II analog; d4-Hydroxy Metabolite Analog; Tetradeuterio-phenyl piperidinyl butanone derivative; Contact for additional synonyms.
EINECS	Contact for details

Quality Control

Our 4-[4-(4-Chloro-2,3,5,6-Tetradeuteriophenyl)-4-Hydroxypiperidin-1-Yl]-1-(3-Ethyl-4-Fluorophenyl)Butan-1-One is manufactured under strict quality systems. Each batch undergoes rigorous analytical testing, including NMR, HPLC, and MS, to confirm identity, chemical purity, and isotopic enrichment. Certificates of Analysis (COA) detailing all specifications are provided and can be tailored to meet specific client or regulatory requirements.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry place at a controlled room temperature (15-25°C). Due to its hygroscopic (moisture-sensitive) nature, the container must be kept sealed under an inert atmosphere (e.g., nitrogen or argon) after opening to prevent degradation. Keep away from incompatible materials.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
Isotopic Enrichment (MS)	≥ 98 atom % D
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%

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