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2-[(2,3-Dichlorophenyl)Sulfanyl]-5-(Trifluoromethyl)Benzenecarbonitrile CAS NO 477866-79-8


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CAS No.:477866-79-8

Grade:Pharmacy Grade

Content:99.9%

Brand:Customizable

Packaging:Customizable

Description

2-[(2,3-Dichlorophenyl)Sulfanyl]-5-(Trifluoromethyl)Benzenecarbonitrile is a high-value, multi-functional organic intermediate featuring a unique combination of a benzonitrile core, a trifluoromethyl group, and a dichlorophenylthioether moiety. This compound matters as a critical building block in advanced chemical synthesis, enabling the development of novel molecules with tailored properties for demanding applications. It is primarily needed by research and development teams in the pharmaceutical and agrochemical industries, where it serves as a key precursor for active ingredients and functional materials.

Application

  • Pharmaceutical Intermediate: Serves as a crucial precursor in the synthesis of novel drug candidates, particularly those targeting central nervous system (CNS) disorders or possessing anti-inflammatory properties.
  • Agrochemical Active Ingredient Synthesis: Used in the research and development of next-generation herbicides, fungicides, and insecticides, leveraging the bioactivity of the trifluoromethyl and dichlorophenyl groups.
  • Material Science Research: Acts as a monomer or functional additive in the development of advanced polymers, liquid crystals, or organic electronic materials due to its aromatic and halogenated structure.
  • Chemical Biology Probe Development: Utilized in creating specialized molecular probes for studying enzyme function or cellular pathways, where the nitrile group can act as a warhead or reporter.
  • Custom Synthesis and Contract Manufacturing: Supplied to CDMOs (Contract Development and Manufacturing Organizations) for use in client-specific, multi-step synthetic routes.

Basic Information

Product Name 2-[(2,3-Dichlorophenyl)Sulfanyl]-5-(Trifluoromethyl)Benzenecarbonitrile
CAS No. 477866-79-8
Molecular Formula C14H6Cl2F3NS
Molecular Weight 348.17 g/mol
Synonyms 2-[(2,3-Dichlorophenyl)thio]-5-(trifluoromethyl)benzonitrile; 5-(Trifluoromethyl)-2-[(2,3-dichlorophenyl)thio]benzonitrile; 2,3-Dichlorophenyl 5-cyano-2-(trifluoromethyl)phenyl sulfide; Benzonitrile, 2-[(2,3-dichlorophenyl)thio]-5-(trifluoromethyl)-; 477866-79-8; SCHEMBL23883079; ZINC000006068007
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Quality Control

Our 2-[(2,3-Dichlorophenyl)Sulfanyl]-5-(Trifluoromethyl)Benzenecarbonitrile is manufactured under a strict quality management system. Every batch undergoes rigorous analytical testing, including HPLC, GC, NMR, and mass spectrometry, to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing all critical specifications. Our commitment to cGMP principles and ISO-aligned procedures guarantees a reliable supply of high-purity material for your most sensitive applications.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (15-25°C). This product is hygroscopic (moisture-sensitive) and light-sensitive; therefore, containers must be kept sealed under an inert atmosphere (e.g., nitrogen or argon) when not in use to prevent degradation. Keep away from heat, sparks, and open flame.

Specification

Item Specification
Appearance White to off-white crystalline powder
Identification (IR) Conforms to structure
Identification (NMR) Conforms to structure
Purity (HPLC) ≥ 98.0%
Water Content (KF) ≤ 0.5%
Residue on Ignition ≤ 0.1%
Single Unknown Impurity (HPLC) ≤ 0.5%
Total Impurities (HPLC) ≤ 2.0%

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

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