Description

Ethanone, 1-(1,3-Cyclohexadien-1-Yl)-2,2,2-Trifluoro- (9Ci) is a specialized trifluoromethyl ketone derivative that serves as a valuable building block in advanced organic synthesis. Its unique structure, featuring a conjugated diene and a highly electrophilic trifluoroacetyl group, makes it a versatile intermediate for constructing complex fluorinated molecules. This compound is particularly sought after by research and development teams in the pharmaceutical and agrochemical sectors for the synthesis of novel active ingredients.

Application

• Pharmaceutical Intermediate: Key precursor in the synthesis of fluorinated drug candidates, leveraging the trifluoromethyl group to enhance metabolic stability and bioavailability.
• Agrochemical Research: Used in developing novel pesticides and herbicides where the fluorine atoms contribute to improved activity and environmental persistence.
• Material Science: Serves as a monomer or cross-linking agent in the development of specialty polymers with unique surface properties and chemical resistance.
• Organic Synthesis Reagent: Acts as a dienophile in Diels-Alder reactions or as an electrophile in nucleophilic addition reactions for constructing complex carbocyclic and heterocyclic frameworks.
• Ligand & Catalyst Development: Utilized in the preparation of novel ligands for asymmetric catalysis, particularly in reactions requiring fine steric and electronic tuning.
• Fluorine Chemistry Research: A critical compound for academic and industrial research focused on understanding and applying fluorination strategies.

Basic Information

Product Name	Ethanone, 1-(1,3-Cyclohexadien-1-Yl)-2,2,2-Trifluoro- (9Ci)
CAS No.	161096-44-2
Molecular Formula	C9H9F3O
Molecular Weight	190.16 g/mol
Synonyms	1-(1,3-Cyclohexadien-1-yl)-2,2,2-trifluoroethanone; 2,2,2-Trifluoro-1-(1,3-cyclohexadien-1-yl)ethanone; 1,3-Cyclohexadien-1-yl trifluoromethyl ketone; Trifluoroacetyl-1,3-cyclohexadiene; (1,3-Cyclohexadien-1-yl)(trifluoroacetyl); 1-(Cyclohexa-1,3-dien-1-yl)-2,2,2-trifluoroethanone
EINECS	Contact for details

Quality Control

Our production of Ethanone, 1-(1,3-Cyclohexadien-1-Yl)-2,2,2-Trifluoro- (9Ci) adheres to stringent quality management protocols. Every batch undergoes comprehensive analytical testing, including HPLC for purity and GC-MS, NMR (1H, 19F, 13C), and IR for structural confirmation and impurity profiling. We provide a detailed Certificate of Analysis (COA) with each shipment, ensuring traceability and compliance with your research or production specifications.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, well-ventilated area at a controlled room temperature (15-25°C). This compound is sensitive to strong alkalis and fluorides; keep away from incompatible materials. For long-term storage, consider under an inert atmosphere to maintain optimal purity.

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
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.