Description

Benzeneacetonitrile, 3-fluoro-α-[(1-methyl-1H-pyrrol-2-yl)methylene]- is a specialized fluorinated nitrile derivative with a pyrrole-based substituent, serving as a high-value synthetic intermediate. This compound is critical for enabling complex molecular transformations in advanced chemical synthesis, offering a unique structural motif for constructing heterocyclic frameworks. It is primarily needed by research and development chemists in the pharmaceutical and agrochemical industries for the discovery and development of novel active ingredients.

Application

• Pharmaceutical Intermediate: A key building block in the synthesis of novel drug candidates, particularly those targeting central nervous system (CNS) disorders and other therapeutic areas.
• Agrochemical Research: Used in the development of new pesticides and herbicides, leveraging its fluorinated structure for enhanced biological activity and metabolic stability.
• Material Science Precursor: Serves as a monomer or functionalization agent in the creation of specialized polymers and advanced organic materials.
• Chemical Biology Probe: Utilized in the design and synthesis of molecular probes for studying enzyme mechanisms and biological pathways.
• Organic Synthesis Reagent: Acts as a versatile electrophile or Michael acceptor in complex organic reactions, facilitating carbon-carbon bond formation.

Basic Information

Product Name	Benzeneacetonitrile, 3-fluoro-α-[(1-methyl-1H-pyrrol-2-yl)methylene]-
CAS No.	831214-09-6
Molecular Formula	C14H11FN2
Molecular Weight	226.25 g/mol
Synonyms	3-Fluoro-α-[(1-methyl-1H-pyrrol-2-yl)methylene]benzeneacetonitrile; (Z)-2-(3-Fluorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)acrylonitrile; 3-Fluoro-α-(1-methylpyrrol-2-ylmethylene)phenylacetonitrile; 2-(3-Fluorobenzylidene)-3-(1-methyl-1H-pyrrol-2-yl)acrylonitrile; 831214-09-6; Fluorinated pyrrole acrylonitrile derivative; Arylidene nitrile intermediate.
EINECS	Contact for details

Quality Control

Our products undergo rigorous quality testing to ensure compliance with industry standards. We provide Certificates of Analysis (COA) with each batch, detailing purity, identity, and impurity profiles. Quality is assured through analytical methods including HPLC, GC, NMR, and mass spectrometry. For custom synthesis projects, we adhere to cGMP and ISO 9001 quality management principles to meet specific client requirements.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (typically 15-25°C). Keep away from heat, sparks, and open flame. The container should be kept tightly sealed in a dry environment to prevent moisture absorption.

Specification

Item	Specification
Appearance	Off-white to light yellow crystalline powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details
Loss on Drying	≤ 0.5%
Residue on Ignition	≤ 0.1%
Heavy Metals	≤ 10 ppm

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