Description

Propanedinitrile, (3,3,3-Trifluoro-2-Oxopropyl)- (9Ci) (CAS No. 771555-86-3) is a specialized fluorinated building block of significant interest in advanced organic synthesis. Its molecular structure, featuring both a dinitrile and a trifluoromethyl ketone moiety, makes it a versatile precursor for constructing complex molecules with tailored properties. This compound is particularly valuable for researchers and process chemists in the pharmaceutical and agrochemical industries seeking to introduce fluorine atoms and functional diversity into target molecules.

Application

• Pharmaceutical Intermediate: Serves as a key synthon for the development of novel active pharmaceutical ingredients (APIs), especially those requiring trifluoromethyl or cyano groups to modulate bioavailability and metabolic stability.
• Agrochemical Synthesis: Used in the research and production of advanced herbicides, fungicides, and insecticides, where the fluorine atoms enhance biological activity and environmental persistence.
• Material Science Precursor: Employed in the synthesis of specialty polymers, liquid crystals, and organic electronic materials that benefit from the unique electronic properties of fluorine.
• Fluorine Chemistry Research: Acts as a fundamental reagent in academic and industrial R&D for exploring new fluorination methodologies and creating fluorinated compound libraries.
• Fine Chemical Manufacturing: Utilized in custom synthesis and contract manufacturing for producing high-value, low-volume fluorinated fine chemicals.

Basic Information

Product Name	Propanedinitrile, (3,3,3-Trifluoro-2-Oxopropyl)- (9Ci)
CAS No.	771555-86-3
Molecular Formula	C6H3F3N2O
Molecular Weight	176.10 g/mol
Synonyms	(3,3,3-Trifluoro-2-oxopropyl)propanedinitrile; 2-(1,3-Dicyano-2-oxopropyl)-1,1,1-trifluoroacetone; 1,1,1-Trifluoro-2,4-dioxopentanedinitrile; 3,3,3-Trifluoro-2-oxopentanedinitrile; 771555-86-3; Propanedinitrile, (3,3,3-trifluoro-2-oxopropyl)-
EINECS	Contact for details

Quality Control

Every batch of Propanedinitrile, (3,3,3-Trifluoro-2-Oxopropyl)- (9Ci) is manufactured under a strict quality management system. We employ advanced analytical techniques, including HPLC, GC, NMR, and mass spectrometry, to ensure identity, purity, and consistency. A comprehensive Certificate of Analysis (COA) detailing all test results is provided with each shipment, ensuring full traceability and compliance with your research or production specifications.

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 product is hygroscopic (moisture-sensitive) and light-sensitive; therefore, containers must be kept tightly sealed and away from direct light to maintain stability and purity.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
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.