Description

5-Chloro-6-(1-Cyclohexen-1-Yl)-Benzene-1,2,3,4-D4 is a deuterated aromatic compound featuring a chlorinated benzene ring fused with a cyclohexenyl moiety. This specialized isotopically labeled chemical is critical for applications requiring precise molecular tracking and analysis, offering enhanced stability and distinct spectral properties compared to its non-deuterated counterpart. It serves as a valuable intermediate for researchers and manufacturers in the pharmaceutical and agrochemical sectors, particularly in the development of deuterated active pharmaceutical ingredients (APIs) and advanced materials.

Application

• Deuterated Pharmaceutical Intermediate: A key building block in the synthesis of deuterium-labeled drug candidates for improved metabolic stability and pharmacokinetic studies.
• Metabolic Pathway Tracer: Used in mass spectrometry and NMR-based research to trace and quantify metabolic pathways and drug distribution in biological systems.
• Internal Standard for Analytical Chemistry: Serves as a high-purity internal standard in quantitative LC-MS and GC-MS analysis for accurate measurement of its non-labeled analogs.
• Agrochemical Research: Employed in the development and environmental fate studies of novel, labeled agrochemicals and pesticides.
• Material Science Research: Investigated for its potential in creating specialized organic electronic materials where isotopic labeling can influence charge transport properties.
• Chemical Mechanism Elucidation: Utilized in mechanistic studies to understand reaction pathways and kinetics through isotopic labeling effects.

Basic Information

Product Name	5-Chloro-6-(1-Cyclohexen-1-Yl)-Benzene-1,2,3,4-D4
CAS No.	1336986-06-1
Molecular Formula	C12H9D4Cl
Molecular Weight	204.72 g/mol (approx.)
Synonyms	5-Chloro-6-(cyclohex-1-en-1-yl)benzene-1,2,3,4-d4; 1,2,3,4-Tetradeutero-5-chloro-6-(1-cyclohexen-1-yl)benzene; Deuterated 5-Chloro-6-(1-cyclohexenyl)benzene; 5-Chloro-6-(cyclohex-1-en-1-yl)-1,2,3,4-tetradeuterobenzene; [1,2,3,4-D4]-5-Chloro-6-(1-cyclohexenyl)benzene
EINECS	Contact for details

Quality Control

Our 5-Chloro-6-(1-Cyclohexen-1-Yl)-Benzene-1,2,3,4-D4 is manufactured under strict quality control protocols to ensure high isotopic and chemical purity suitable for sensitive research and development. Each batch is supported by a comprehensive Certificate of Analysis (COA) detailing key parameters such as isotopic enrichment (D-atom %), chemical purity, and impurity profile. We adhere to relevant industry standards, and specifications can be tailored to meet specific project requirements for pharmaceutical or analytical applications.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (typically 15-25°C). Keep away from heat sources and incompatible materials. For long-term storage under inert atmosphere, please contact our technical team for specific recommendations.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
Isotopic Enrichment (D-atom %)	≥ 98.0% (by 1H-NMR or MS)
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.