Description

4-[3-(Trifluoromethyl)Phenyl]Oxane-4-Carbonitrile is a high-value, fluorinated organic building block characterized by its oxane (tetrahydropyran) ring and nitrile functionality. This compound matters for its role as a versatile synthon in advanced pharmaceutical and agrochemical research, enabling the introduction of both trifluoromethylphenyl and cyano-substituted tetrahydropyran motifs into target molecules. It is primarily needed by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and material science industries for constructing complex molecular architectures.

Application

• Pharmaceutical Intermediate: Key building block for the synthesis of novel active pharmaceutical ingredients (APIs), particularly in central nervous system (CNS) and metabolic disease research.
• Agrochemical Synthesis: Used in the development of advanced herbicides, fungicides, and insecticides where the trifluoromethyl group enhances biological activity and metabolic stability.
• Ligand and Catalyst Development: Serves as a precursor for chiral ligands or organocatalysts in asymmetric synthesis, leveraging the stereogenic center of the oxane ring.
• Material Science Research: Employed in the creation of specialty polymers and liquid crystals, where its rigid-rod structure and fluorine content can modify material properties.
• Chemical Biology Probes: Utilized as a scaffold for developing molecular probes and inhibitors to study enzyme function and biological pathways.

Basic Information

Product Name	4-[3-(Trifluoromethyl)Phenyl]Oxane-4-Carbonitrile
CAS No.	1035261-83-6
Molecular Formula	C13H12F3NO
Molecular Weight	255.24 g/mol
Synonyms	4-(3-(Trifluoromethyl)phenyl)tetrahydro-2H-pyran-4-carbonitrile; 4-(3-Trifluoromethylphenyl)tetrahydropyran-4-carbonitrile; 4-Cyano-4-(3-trifluoromethylphenyl)tetrahydropyran; 4-(3-Trifluoromethylphenyl)-4-cyanotetrahydropyran; 4-(α,α,α-Trifluoro-m-tolyl)tetrahydro-2H-pyran-4-carbonitrile; 1035261-83-6; 4-(3-(Trifluoromethyl)phenyl)oxane-4-carbonitrile
EINECS	Contact for details

Quality Control

Our 4-[3-(Trifluoromethyl)Phenyl]Oxane-4-Carbonitrile is manufactured under strict quality management systems. Every batch undergoes rigorous analytical testing, including HPLC, GC, NMR, and mass spectrometry, to ensure high purity and consistent performance. Certificates of Analysis (COA) detailing identity, purity, and impurity profiles are provided with each shipment to support your quality assurance and regulatory needs.

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). Due to its hygroscopic (moisture-sensitive) nature, the container must be kept tightly sealed under an inert atmosphere (e.g., nitrogen or argon) after opening to prevent degradation.

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%
Heavy Metals	≤ 10 ppm

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