Description

3-Oxo-3-[4-(Trifluoromethyl)Phenyl]Propanenitrile is a versatile and high-value organic intermediate characterized by its ketone and nitrile functional groups attached to a trifluoromethylphenyl core. This compound is essential for synthesizing advanced molecules where the trifluoromethyl group imparts desirable properties such as enhanced metabolic stability, lipophilicity, and bioavailability. It is primarily sought after by research and development teams in the pharmaceutical and agrochemical industries for constructing novel active ingredients.

Application

• Pharmaceutical Intermediate: Key building block for the synthesis of active pharmaceutical ingredients (APIs), particularly in the development of anti-inflammatory, antiviral, and anticancer agents.
• Agrochemical Synthesis: Used in the production of advanced herbicides, fungicides, and insecticides, where the trifluoromethyl group enhances biological activity and environmental persistence.
• Material Science Research: Serves as a precursor for specialty polymers, liquid crystals, and organic electronic materials due to its unique electronic properties.
• Organic Synthesis & Catalysis: A valuable substrate in cross-coupling reactions, Michael additions, and cyclization reactions for constructing complex heterocyclic frameworks.
• Fluorine Chemistry Studies: An important compound for research into the effects of fluorine substitution on molecular reactivity and physical properties.

Basic Information

Product Name	3-Oxo-3-[4-(Trifluoromethyl)Phenyl]Propanenitrile
CAS No.	71682-94-5
Molecular Formula	C10H6F3NO
Molecular Weight	213.16 g/mol
Synonyms	4'-(Trifluoromethyl)benzoylacetonitrile; 3-Oxo-3-[4-(trifluoromethyl)phenyl]propanenitrile; 4-(Trifluoromethyl)benzoylacetonitrile; 1-[4-(Trifluoromethyl)phenyl]-1,3-propanedione-3-carbonitrile; 3-(4-Trifluoromethylphenyl)-3-oxopropanenitrile; 3-Oxo-3-(4-trifluoromethylphenyl)propionitrile; TFMPA; Contact for additional names.
EINECS	Contact for details

Quality Control

Our production of 3-Oxo-3-[4-(Trifluoromethyl)Phenyl]Propanenitrile adheres to stringent in-process controls and final batch testing to ensure high purity and consistent quality. Every lot is analyzed using advanced techniques including HPLC, GC, and NMR spectroscopy. A comprehensive Certificate of Analysis (COA) detailing purity, identity, and impurity profiles is provided with each shipment to support your quality assurance protocols.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at room temperature (15-25°C). Due to its hygroscopic nature, the container must be kept tightly sealed to exclude moisture. Keep away from incompatible materials such as strong bases and reducing agents.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Assay (HPLC)	≥ 98.0%
Melting Point	Contact for details
Loss on Drying	≤ 0.5%
Related Substances (HPLC)	Individual impurity ≤ 0.5%; Total impurities ≤ 1.5%

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