110888-15-8 | 4-Chloro-3-fluorobenzonitrile

CAS:110888-15-8 | 4-Chloro-3-fluorobenzonitrile,Description

Synthesis Analysis

The synthesis of 4-Chloro-3-fluorobenzonitrile involves complex chemical procedures. An example of a synthesis method includes the reaction of chloral with substituted anilines, leading to the formation of respective 2,2,2-trichloroethylidene anilines. Subsequent treatment with thioglycolic acid produces a series of substituted compounds, demonstrating the versatility and complexity of synthesis routes (Issac & Tierney, 1996).

Molecular Structure Analysis

The molecular structure of 4-Chloro-3-fluorobenzonitrile, characterized by the presence of chloro and fluoro substituents on the benzene ring, significantly influences its physical and chemical properties. The arrangement of these substituents impacts its reactivity and interaction with other molecules. Studies on similar fluorinated compounds highlight the role of fluorine in enhancing stability and modifying electronic properties, which can be extrapolated to understand the molecular behavior of 4-Chloro-3-fluorobenzonitrile (Hird, 2007).

Chemical Reactions and Properties

4-Chloro-3-fluorobenzonitrile undergoes various chemical reactions, including halogenation, nucleophilic substitution, and coupling reactions. Its fluorine atom can act as a hydrogen bond acceptor, influencing its interactions and reactivity (Howard et al., 1996). The presence of chlorine further diversifies its chemical behavior, making it a versatile intermediate in organic synthesis.

Scientific Research Applications

• General Use

  • Application Summary : 4-Chloro-3-fluorobenzonitrile is a key intermediate in the synthesis of other fluorobenzonitriles. It’s used in organic synthesis due to its reactivity and the presence of a nitrile group, which can undergo various reactions to form a wide range of products.
  • Results or Outcomes : The outcomes can also vary widely, as this compound is a precursor to many different products. The specific results would depend on the other reactants and the conditions of the reaction.

• Specific Application

  • Application Summary : 4-Chloro-3-fluorobenzonitrile has been used in the preparation of ethyl 5-(2-chloro-4-cyanophenoxy)indoline-1-carboxylate and 3-chloro-4-(indolin-5-yloxy)benzonitrile.
  • Methods of Application : The specific methods of application would involve reacting 4-Chloro-3-fluorobenzonitrile with other compounds under controlled conditions to form the desired products.
  • Results or Outcomes : The result of this application would be the formation of ethyl 5-(2-chloro-4-cyanophenoxy)indoline-1-carboxylate and 3-chloro-4-(indolin-5-yloxy)benzonitrile.
• Fluorination Reagents
  • Application Summary : 4-Chloro-3-fluorobenzonitrile is used as a fluorination reagent. Fluorination reagents are used to introduce a fluorine atom or fluorine-containing functional group to a molecule in the process of fluorination.
  • Methods of Application : The specific methods of application can vary widely depending on the desired end product. Typically, it would be used in a reaction with other organic compounds under controlled conditions.
  • Results or Outcomes : The outcomes can also vary widely, as this compound is a precursor to many different products. The specific results would depend on the other reactants and the conditions of the reaction.
• Fluorinated Building Blocks
  • Application Summary : 4-Chloro-3-fluorobenzonitrile is used as a fluorinated building block. Fluorinated building blocks are used in the synthesis of various fluorinated compounds.
  • Methods of Application : The specific methods of application can vary widely depending on the desired end product. Typically, it would be used in a reaction with other organic compounds under controlled conditions.
  • Results or Outcomes : The outcomes can also vary widely, as this compound is a precursor to many different products. The specific results would depend on the other reactants and the conditions of the reaction.

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