Description

2-Cyano-2,2,2-Trifluoroacetophenone Hydrate is a specialized fluorinated and cyanated acetophenone derivative, serving as a high-value synthetic intermediate in advanced organic chemistry. Its molecular structure, featuring both a trifluoromethyl and a cyano group, makes it a critical precursor for constructing complex molecules with enhanced properties. This compound is primarily utilized by research and development chemists in the pharmaceutical and agrochemical industries for the synthesis of novel active ingredients and fine chemicals.

Application

• Pharmaceutical Intermediate: Key building block for the synthesis of active pharmaceutical ingredients (APIs), particularly those requiring trifluoromethyl or cyano functional groups for bioactivity or metabolic stability.
• Agrochemical Synthesis: Used in the research and production of advanced pesticides and herbicides, where the fluorine atoms can improve lipophilicity and environmental persistence.
• Material Science Research: Serves as a monomer or precursor for developing specialty polymers and advanced materials with unique optical or electronic properties.
• Ligand and Catalyst Development: Employed in organic and organometallic chemistry to create novel ligands and catalysts for asymmetric synthesis and cross-coupling reactions.
• Fluorine Chemistry Studies: A valuable reagent for academic and industrial research focused on introducing fluorine atoms into complex molecular architectures.
• Fine Chemical Production: Intermediate in the multi-step synthesis of complex, high-value specialty chemicals for various industrial applications.

Basic Information

Product Name	2-Cyano-2,2,2-Trifluoroacetophenone Hydrate
CAS No.	1134303-97-1
Molecular Formula	C9H6F3NO2 (anhydrous basis) / C9H8F3NO3 (hydrate)
Molecular Weight	217.14 g/mol (anhydrous) / 235.16 g/mol (hydrate)
Synonyms	α-Cyano-α,α,α-trifluoroacetophenone Hydrate; 2,2,2-Trifluoro-1-cyano-1-phenylethanone Hydrate; 1-Phenyl-2,2,2-trifluoro-1-cyanoethanone Hydrate; Trifluoromethyl(cyanophenyl)methanone Hydrate; (Cyanotrifluoromethyl)phenylmethanone Hydrate; TFAP-CN Hydrate; 2-Cyano-2,2,2-trifluoro-1-phenylethanone Hydrate
EINECS	Contact for details

Quality Control

Our 2-Cyano-2,2,2-Trifluoroacetophenone Hydrate is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC for purity and NMR for structural confirmation, to ensure it meets precise specifications for research and development use. A comprehensive Certificate of Analysis (COA) detailing identity, purity, and impurity profiles is provided with every shipment.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (15-25°C). Keep the container tightly sealed to minimize exposure to atmospheric moisture.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Assay (HPLC)	≥ 98.0%
Water Content (KF)	Consistent with hydrate form
Related Substances (HPLC)	Total impurities ≤ 2.0%

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