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2-((1S,4S)-4-(4-Chlorophenylsulfonyl)-4-(2,5-Difluorophenyl)Cyclohexyl)Acetonitrile CAS NO 471905-01-8
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CAS No.:471905-01-8
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
2-((1S,4S)-4-(4-Chlorophenylsulfonyl)-4-(2,5-Difluorophenyl)Cyclohexyl)Acetonitrile is a high-purity, advanced pharmaceutical intermediate with a complex, stereochemically defined structure. This compound is critical for the synthesis of novel active pharmaceutical ingredients (APIs), particularly in therapeutic areas requiring high selectivity and potency. It is primarily utilized by research institutions and pharmaceutical manufacturers engaged in the development of new chemical entities, especially for central nervous system (CNS) and oncology targets.
Application
- Pharmaceutical Intermediate: Key building block in the synthesis of novel small-molecule drug candidates, particularly for CNS disorders.
- Preclinical Research: Used in medicinal chemistry programs for structure-activity relationship (SAR) studies and lead optimization.
- Process Chemistry Development: Serves as a critical chiral intermediate for scaling up API synthesis under Good Manufacturing Practice (GMP) conditions.
- Contract Research & Manufacturing (CRAM): Supplied to organizations specializing in custom synthesis and development of complex organic molecules.
- Chemical Biology Probes: Potential use in the development of selective enzyme inhibitors or receptor modulators for research purposes.
Basic Information
| Item | Details |
|---|---|
| Product Name | 2-((1S,4S)-4-(4-Chlorophenylsulfonyl)-4-(2,5-Difluorophenyl)Cyclohexyl)Acetonitrile |
| CAS No. | 471905-01-8 |
| Molecular Formula | C20H18ClF2NO2S |
| Molecular Weight | 409.88 g/mol |
| Synonyms | (1S,4S)-2-[4-[(4-Chlorophenyl)sulfonyl]-4-(2,5-difluorophenyl)cyclohexyl]acetonitrile; 2-[(1S,4S)-4-(4-Chlorobenzenesulfonyl)-4-(2,5-difluorophenyl)cyclohexyl]acetonitrile; 471905-01-8; (1S,4S)-4-(4-Chlorophenylsulfonyl)-4-(2,5-difluorophenyl)cyclohexylacetonitrile; CAS 471905-01-8 |
| EINECS | Contact for details |
Quality Control
Every batch of 2-((1S,4S)-4-(4-Chlorophenylsulfonyl)-4-(2,5-Difluorophenyl)Cyclohexyl)Acetonitrile is manufactured and tested under a strict quality management system. We provide comprehensive analytical data to ensure the identity, purity, and consistency required for pharmaceutical research and development. A detailed Certificate of Analysis (COA) is supplied with each shipment, documenting critical parameters such as chiral purity, chemical purity (HPLC), and residual solvents.
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 material is hygroscopic (moisture-sensitive) and should be handled under dry conditions to prevent degradation.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white solid |
| Identification (IR) | Conforms to structure |
| Purity (HPLC) | ≥ 98.0% |
| Chiral Purity (Chiral HPLC) | ≥ 99.0% ee |
| Loss on Drying | ≤ 0.5% |
| Residual Solvents (GC) | Meets ICH Q3C guidelines |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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