Description

4-(Propan-2-Yloxy)-2-(Trifluoromethyl)Benzonitrile is a high-value, fluorinated aromatic nitrile building block of significant interest in advanced organic synthesis. This compound matters for its unique molecular architecture, which combines an ether-linked isopropyl group with a trifluoromethyl substituent on a benzonitrile core, enabling precise modulation of electronic and steric properties in target molecules. It is primarily needed by R&D chemists and process development scientists in the pharmaceutical and agrochemical industries for the development of novel active ingredients, as well as by manufacturers of specialty materials and liquid crystals.

Application

• Pharmaceutical Intermediate: A key synthon for constructing complex molecules in drug discovery programs, particularly for candidates targeting central nervous system (CNS) disorders, inflammation, and metabolic diseases.
• Agrochemical Active Ingredient Development: Serves as a precursor in the synthesis of novel herbicides, fungicides, and insecticides, where the trifluoromethyl group enhances biological activity and environmental stability.
• Liquid Crystal & OLED Material Synthesis: Used in the preparation of fluorinated components for advanced display technologies, contributing to improved dielectric anisotropy and thermal stability.
• Organic Electronic Material Precursor: Employed in the research and development of semiconductors, charge-transport materials, and other components for organic light-emitting diodes (OLEDs) and photovoltaics.
• Specialty Polymer Modifier: Acts as a monomer or functionalization agent to introduce fluorine atoms into polymer backbones, enhancing chemical resistance, lowering surface energy, and improving thermal properties.
• Cross-Coupling Reaction Substrate: An excellent substrate for palladium-catalyzed reactions (e.g., Suzuki, Buchwald-Hartwig) due to the presence of the nitrile and ether functionalities, enabling rapid diversification of chemical libraries.

Basic Information

Product Name	4-(Propan-2-Yloxy)-2-(Trifluoromethyl)Benzonitrile
CAS No.	1094436-68-6
Molecular Formula	C11H10F3NO
Molecular Weight	229.20 g/mol
Synonyms	2-(Trifluoromethyl)-4-isopropoxybenzonitrile; 4-Isopropoxy-2-(trifluoromethyl)benzonitrile; 4-(1-Methylethoxy)-2-(trifluoromethyl)benzonitrile; 2-Trifluoromethyl-4-isopropoxybenzonitrile; Benzonitrile, 4-(1-methylethoxy)-2-(trifluoromethyl)-; 4-(Propan-2-yloxy)-2-(trifluoromethyl)benzonitrile
EINECS	Contact for details

Quality Control

Our 4-(Propan-2-Yloxy)-2-(Trifluoromethyl)Benzonitrile is manufactured under strict quality management systems. Every batch undergoes rigorous analytical testing, including HPLC, GC, NMR, and MS, to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing all critical quality attributes. Our production adheres to cGMP principles where applicable, ensuring reliability for research and scale-up activities.

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). Keep the container tightly sealed in a dry environment to minimize moisture uptake. Keep away from strong oxidizing agents.

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%

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