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4-[(E)-3-(1,3-Benzodioxol-4-Yl)-2-Cyano-2-Propenoyl]Benzenecarbonitrile CAS NO 900014-98-4


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CAS No.:900014-98-4

Grade:Pharmacy Grade

Content:99.9%

Brand:Customizable

Packaging:Customizable

Description

4-[(E)-3-(1,3-Benzodioxol-4-Yl)-2-Cyano-2-Propenoyl]Benzenecarbonitrile is a specialized organic compound featuring a benzodioxole core conjugated with a cyano-substituted propenoyl benzonitrile structure. This molecular architecture makes it a valuable high-purity intermediate for advanced chemical synthesis, particularly in the development of complex heterocyclic systems and functional materials. It is primarily utilized by pharmaceutical research and agrochemical development laboratories, as well as by manufacturers of specialty dyes and advanced organic electronic materials.

Application

  • Pharmaceutical Intermediate: A key building block in the synthesis of novel active pharmaceutical ingredients (APIs), particularly for compounds targeting neurological and oncological pathways.
  • Agrochemical Research: Serves as a precursor for developing new-generation herbicides, fungicides, and plant growth regulators with enhanced efficacy.
  • Organic Electronic Materials: Used in the research and development of organic semiconductors, light-emitting diodes (OLEDs), and photovoltaic materials due to its conjugated π-system.
  • Specialty Dyes and Pigments: Functions as an intermediate for synthesizing high-performance, light-fast dyes and functional pigments.
  • Ligand Synthesis: Employed in the preparation of complex ligands for catalysis and metal-organic frameworks (MOFs).
  • Academic & Industrial R&D: A valuable reagent for methodological studies in organic chemistry, including cycloaddition and cross-coupling reactions.

Basic Information

Product Name 4-[(E)-3-(1,3-Benzodioxol-4-Yl)-2-Cyano-2-Propenoyl]Benzenecarbonitrile
CAS No. 900014-98-4
Molecular Formula C18H10N2O3
Molecular Weight 302.29 g/mol
Synonyms 4-[(E)-3-(1,3-Benzodioxol-4-yl)-2-cyanoprop-2-enoyl]benzonitrile; (E)-4-(3-(Benzo[d][1,3]dioxol-4-yl)-2-cyanoacryloyl)benzonitrile; 2-Cyano-3-(1,3-benzodioxol-4-yl)-1-(4-cyanophenyl)-2-propen-1-one; 4-(3-(1,3-Benzodioxol-4-yl)-2-cyanoacryloyl)benzonitrile; (E)-4-(3-(1,3-Benzodioxol-4-yl)-2-cyanoacryloyl)benzonitrile; 900014-98-4; Contact for details on additional trade names.
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Quality Control

Our production of 4-[(E)-3-(1,3-Benzodioxol-4-Yl)-2-Cyano-2-Propenoyl]Benzenecarbonitrile adheres to a stringent quality management system. Every batch undergoes comprehensive analytical testing, including HPLC, NMR, and mass spectrometry, to ensure identity, purity, and consistency. We provide detailed Certificates of Analysis (COA) with each shipment, documenting all critical parameters. Our quality commitment supports compliance with cGMP and ISO 9001 standards for research and industrial use.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (15-25°C). Keep away from heat, sparks, and open flame. Due to its light-sensitive nature, handling and packaging should minimize exposure to direct light.

Specification

Item Specification
Appearance Yellow to light brown crystalline powder
Identification (IR) Conforms to structure
Identification (HPLC) Retention time matches reference standard
Purity (HPLC) ≥ 97.0% (Area %)
Water Content (KF) ≤ 0.5%
Residue on Ignition ≤ 0.1%
Heavy Metals (as Pb) ≤ 20 ppm

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

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