Description

5-Oxo-5-(4-Trifluoromethylphenyl)Valeronitrile is a high-value, versatile chemical intermediate characterized by its nitrile and ketone functional groups attached to a trifluoromethylphenyl core. This compound matters for its role as a critical building block in the synthesis of complex molecules, particularly in advanced pharmaceutical and agrochemical research. It is primarily needed by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and specialty chemical industries for constructing active pharmaceutical ingredients (APIs) and novel crop protection agents.

Application

• Pharmaceutical Intermediate: A key synthon for the preparation of biologically active molecules, including potential kinase inhibitors and receptor modulators.
• Agrochemical Synthesis: Used in the research and development of novel herbicides, fungicides, and insecticides leveraging the trifluoromethyl group for enhanced activity and stability.
• Liquid Crystal & OLED Material Precursor: Serves as a building block for advanced organic electronic materials due to its aromatic and polarizable structure.
• Organic Synthesis Building Block: Utilized in academic and industrial research for constructing complex organic frameworks via reactions at the ketone and nitrile functionalities.
• Fluorinated Compound Library Development: Essential for medicinal chemistry programs focused on creating fluorinated compound libraries to explore structure-activity relationships.

Basic Information

Product Name	5-Oxo-5-(4-Trifluoromethylphenyl)Valeronitrile
CAS No.	61718-86-3
Molecular Formula	C₁₃H₁₂F₃NO
Molecular Weight	255.24 g/mol
Synonyms	5-Oxo-5-[4-(trifluoromethyl)phenyl]pentanenitrile; 4-(4-Trifluoromethylbenzoyl)butyronitrile; 5-Oxo-5-(4-trifluoromethylphenyl)valeronitrile; γ-Oxo-4-(trifluoromethyl)benzenebutanenitrile; Pentanenitrile, 5-oxo-5-[4-(trifluoromethyl)phenyl]-; 4-(4-Trifluoromethylphenyl)-4-oxobutyronitrile; 4-(4-Trifluoromethylbenzoyl)butanenitrile
EINECS	Contact for details

Quality Control

Every batch of 5-Oxo-5-(4-Trifluoromethylphenyl)Valeronitrile is produced under strict quality management protocols. We employ advanced analytical techniques including HPLC, GC, NMR, and IR spectroscopy to ensure identity, purity, and consistency. Our products undergo rigorous quality testing to ensure compliance with industry standards. Certificates of Analysis (COA) detailing batch-specific results are available upon request.

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 nature, the container must be kept tightly sealed to exclude moisture. Keep away from heat, sparks, and open flame.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
Melting Point	Contact for details
Loss on Drying	≤ 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.