Description

3-Octylthio-1,1,1-Trifluoro-2-Propanone is a specialized organosulfur and organofluorine compound, serving as a high-value building block in advanced chemical synthesis. Its unique structure, featuring both a thioether and a trifluoromethyl ketone group, makes it a critical intermediate for introducing specific functional motifs into target molecules. This compound is essential for researchers and manufacturers in the pharmaceutical, agrochemical, and materials science sectors who require precise fluorinated synthons for developing novel active ingredients and functional materials.

Application

• Pharmaceutical Intermediate: Key building block for the synthesis of fluorinated drug candidates, particularly in protease inhibitor and anti-inflammatory research.
• Agrochemical Synthesis: Used in the development of novel pesticides and herbicides, where the trifluoromethyl group enhances biological activity and metabolic stability.
• Ligand and Catalyst Precursor: Serves as a starting material for creating specialized ligands in transition metal catalysis and organocatalysis.
• Advanced Material Research: Employed in the synthesis of fluorinated polymers and specialty chemicals with unique surface properties and stability.
• Chemical Biology Probes: Utilized in the design of activity-based probes and inhibitors for studying enzyme mechanisms.
• Custom Synthesis and R&D: A vital reagent for contract research organizations and academic laboratories exploring new synthetic methodologies involving sulfur and fluorine chemistry.

Basic Information

Product Name	3-Octylthio-1,1,1-Trifluoro-2-Propanone
CAS No.	89820-00-8
Molecular Formula	C11H19F3OS
Molecular Weight	256.33 g/mol
Synonyms	1,1,1-Trifluoro-3-(octylthio)-2-propanone; 3-(Octylthio)-1,1,1-trifluoroacetone; 1,1,1-Trifluoro-3-octylsulfanyl-propan-2-one; Octyl 3-oxo-4,4,4-trifluorobutyl sulfide; 3-(Octylsulfanyl)-1,1,1-trifluoropropan-2-one; 4,4,4-Trifluoro-3-(octylthio)-2-butanone; TFOP-S-Octyl
EINECS	Contact for details

Quality Control

Our 3-Octylthio-1,1,1-Trifluoro-2-Propanone is manufactured under strict quality control protocols to ensure batch-to-batch consistency and high purity suitable for research and commercial synthesis. We provide comprehensive analytical documentation, including Certificates of Analysis (COA) with data from GC, HPLC, NMR, and IR spectroscopy. Our quality system is designed to meet the stringent requirements of cGMP and ISO standards for advanced chemical intermediates.

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). This material is moisture-sensitive (hygroscopic) and should be handled under an inert atmosphere for prolonged storage to maintain stability.

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid
Identification (IR)	Conforms to structure
Purity (GC/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.