Description

2,4,5-Trifluorobenzoylacetonitrile is a versatile fluorinated aromatic building block of significant importance in advanced organic synthesis. Its molecular structure, featuring a trifluoromethyl-substituted benzoyl group attached to an acetonitrile moiety, makes it a critical intermediate for constructing complex molecules with tailored properties. This compound is primarily sought after by research and development teams in the pharmaceutical and agrochemical industries for the synthesis of novel active ingredients, where the introduction of fluorine atoms is a key strategy to modulate bioavailability, metabolic stability, and binding affinity.

Application

• Pharmaceutical Intermediate: A key precursor in the synthesis of fluorinated drug candidates, particularly in oncology, central nervous system (CNS), and anti-infective therapeutic areas.
• Agrochemical Synthesis: Used in the development of new-generation herbicides, fungicides, and insecticides, where fluorine incorporation enhances efficacy and environmental profile.
• Ligand and Catalyst Development: Serves as a starting material for creating specialized ligands used in asymmetric catalysis and metal-organic frameworks (MOFs).
• Material Science Research: Employed in the synthesis of fluorinated organic semiconductors, liquid crystals, and polymers for electronic and optical applications.
• Chemical Biology Probes: Useful for constructing fluorinated probes and tags for studying biological processes and protein interactions.

Basic Information

Product Name	2,4,5-Trifluorobenzoylacetonitrile
CAS No.	142501-42-6
Molecular Formula	C10H5F3NO
Molecular Weight	212.15 g/mol
Synonyms	2,4,5-Trifluorobenzoylacetonitrile; 3-Oxo-3-(2,4,5-trifluorophenyl)propanenitrile; 1-(2,4,5-Trifluorophenyl)-1,3-butanedione-3-carbonitrile; 2,4,5-Trifluoro-β-oxobenzenepropanenitrile; (2,4,5-Trifluorobenzoyl)acetonitrile; 3-(2,4,5-Trifluorobenzoyl)propanenitrile
EINECS	Contact for details

Quality Control

Our 2,4,5-Trifluorobenzoylacetonitrile is manufactured under strict quality management systems. Each batch undergoes comprehensive analytical testing, including HPLC for purity, GC for residual solvents, and NMR/IR for structural confirmation, to ensure it meets the high standards required for research and scale-up activities. A Certificate of Analysis (COA) detailing all specifications is provided with every shipment to guarantee traceability and consistency.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at room temperature (15-25°C). Keep away from strong oxidizing agents, strong bases, and sources of ignition.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details
Water Content (KF)	≤ 0.5%
Residual Solvents (GC)	Meets ICH guidelines

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