Description

4-Ethyl-1-(Trifluoromethyl)-2,6,7-Trioxabicyclo[2.2.2]Octane is a specialized bicyclic orthoester compound, valued for its unique structure that incorporates both an ethyl group and a trifluoromethyl moiety. This chemical is a critical high-purity intermediate and building block in advanced organic synthesis, particularly where the introduction of fluorine-containing functional groups is required. It is essential for research and development chemists in the pharmaceutical, agrochemical, and advanced materials sectors seeking to modify compound properties such as metabolic stability, lipophilicity, and electronic characteristics.

Application

• Pharmaceutical Intermediate: Serves as a key synthon for the development of novel active pharmaceutical ingredients (APIs), especially in fluorinated drug candidates targeting CNS disorders, oncology, and anti-infectives.
• Agrochemical Synthesis: Used in the research and production of advanced pesticides and herbicides, where the trifluoromethyl group can enhance biological activity and environmental stability.
• Advanced Material Precursor: Acts as a monomer or cross-linking agent in the synthesis of specialty polymers, resins, and coatings with tailored thermal, chemical, or surface properties.
• Ligand and Catalyst Development: Employed in organometallic chemistry and catalysis research to create novel ligands that influence reaction selectivity and efficiency.
• Fluorine Chemistry Research: A valuable tool in academic and industrial R&D for studying the effects of fluorine substitution and for constructing complex, polyfunctional molecular architectures.
• Electronic Chemicals: Potential use in the synthesis of precursors for organic light-emitting diodes (OLEDs) or other electronic materials where specific fluorination is beneficial.

Basic Information

Product Name	4-Ethyl-1-(Trifluoromethyl)-2,6,7-Trioxabicyclo[2.2.2]Octane
CAS No.	31185-63-4
Molecular Formula	C8H9F3O3
Molecular Weight	210.15 g/mol
Synonyms	1-(Trifluoromethyl)-4-ethyl-2,6,7-trioxabicyclo[2.2.2]octane; 4-Ethyl-1-trifluoromethyl-2,6,7-trioxabicyclo[2.2.2]octane; Bicyclo[2.2.2]octane, 4-ethyl-1-(trifluoromethyl)-2,6,7-trioxa-; Ethyl-trifluoromethyl-trioxabicyclooctane; TTO Et; 4-Et-TTO; Orthoester fluorinated bicyclic compound
EINECS	Contact for details

Quality Control

Our production of 4-Ethyl-1-(Trifluoromethyl)-2,6,7-Trioxabicyclo[2.2.2]Octane adheres to a strict quality management system to ensure batch-to-batch consistency and high purity. Each lot is characterized and released based on comprehensive analytical testing, including NMR, HPLC, and GC analysis. A detailed Certificate of Analysis (COA) documenting identity, purity, and impurity profiles is provided with every shipment. We support cGMP and ISO 9001 compliant manufacturing for critical applications.

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). Keep away from heat, sparks, and open flame. This material is moisture-sensitive; ensure containers are kept tightly sealed to exclude moisture. For long-term storage, consider storing under an inert atmosphere such as nitrogen or argon.

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid or solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC/GC)	≥ 97.0% (Standard Grade)
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.