Cas no 374064-84-3 (2-(3,5-dimethylphenyl)ethanimidamide)

2-(3,5-Dimethylphenyl)ethanimidamide is a specialized organic compound featuring an ethanimidamide functional group attached to a 3,5-dimethylphenyl moiety. This structure imparts unique reactivity, making it valuable as an intermediate in pharmaceutical and agrochemical synthesis. The presence of the amidine group allows for versatile transformations, including condensation and cyclization reactions, while the aromatic dimethyl substitution enhances stability and influences electronic properties. Its well-defined molecular architecture ensures consistent performance in heterocycle formation and other fine chemical applications. The compound is typically supplied in high purity, ensuring reliability in research and industrial processes. Proper handling and storage under inert conditions are recommended to maintain its integrity.
2-(3,5-dimethylphenyl)ethanimidamide structure
374064-84-3 structure
Product Name:2-(3,5-dimethylphenyl)ethanimidamide
CAS No:374064-84-3
MF:C10H14N2
MW:162.231562137604
CID:297938
PubChem ID:3552891
Update Time:2025-05-22

2-(3,5-dimethylphenyl)ethanimidamide Chemical and Physical Properties

Names and Identifiers

    • Benzeneethanimidamide,3,5-dimethyl-
    • 2-(3,5-dimethylphenyl)ethanimidamide
    • 2-(3,5-dimethylphenyl)acetamidine
    • Benzeneethanimidamide,3,5-dimethyl
    • 374064-84-3
    • 2-(3,5-DIMETHYL-PHENYL)-ACETAMIDINE
    • DTXSID70393577
    • EN300-1255763
    • AKOS010257682
    • 2-(3,5-Dimethylphenyl)acetimidamide
    • Inchi: 1S/C10H14N2/c1-7-3-8(2)5-9(4-7)6-10(11)12/h3-5H,6H2,1-2H3,(H3,11,12)
    • InChI Key: PJVBSBPSXZOUEQ-UHFFFAOYSA-N
    • SMILES: NC(CC1C=C(C)C=C(C)C=1)=N

Computed Properties

  • Exact Mass: 162.11600
  • Monoisotopic Mass: 162.116
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 155
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.6
  • Topological Polar Surface Area: 49.9?2

Experimental Properties

  • PSA: 49.87000
  • LogP: 2.58190

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Additional information on 2-(3,5-dimethylphenyl)ethanimidamide

2-(3,5-Dimethylphenyl)ethanimidamide (CAS No 374064-84-3): A Comprehensive Overview

The compound 2-(3,5-dimethylphenyl)ethanimidamide, identified by the CAS registry number 374064-84-3, is a significant molecule in the field of organic chemistry and materials science. This compound has garnered attention due to its unique structural properties and potential applications in various industries. Recent studies have highlighted its role in drug development, polymer synthesis, and as a precursor for advanced materials. The molecule's structure consists of a central imidamide group attached to a substituted phenyl ring, which contributes to its distinctive chemical behavior.

2-(3,5-Dimethylphenyl)ethanimidamide exhibits interesting electronic properties due to the conjugation between the imidamide group and the aromatic ring. This feature makes it a promising candidate for use in organic electronics, particularly in the development of semiconducting polymers. Researchers have explored its ability to act as a building block for high-performance materials, leveraging its stability and electronic conductivity. Recent advancements in polymer chemistry have demonstrated that incorporating this compound into polymer backbones can significantly enhance the mechanical and thermal properties of the resulting materials.

The synthesis of 2-(3,5-dimethylphenyl)ethanimidamide involves a multi-step process that typically includes nucleophilic substitution and condensation reactions. The starting material is often derived from aromatic aldehydes or ketones, which are subjected to imination followed by cyclization to form the imidamide moiety. This synthetic pathway has been optimized in recent years to improve yield and purity, making it more accessible for large-scale production. The compound's synthesis is also notable for its compatibility with green chemistry principles, as it minimizes the use of hazardous reagents and reduces waste generation.

In terms of applications, 2-(3,5-dimethylphenyl)ethanimidamide has found utility in pharmaceutical research as a bioisostere for other nitrogen-containing heterocycles. Its ability to modulate enzyme activity and interact with biological membranes makes it a valuable tool in drug discovery programs targeting various therapeutic areas. For instance, studies have shown that derivatives of this compound can inhibit key enzymes involved in inflammatory pathways, offering potential leads for anti-inflammatory drugs.

Moreover, CAS No 374064-84-3 has been investigated for its role in catalysis. The compound's ability to act as a Lewis acid catalyst has been exploited in asymmetric synthesis reactions, where it facilitates the formation of chiral centers with high enantioselectivity. This property has implications for the production of chiral pharmaceuticals and fine chemicals, where high optical purity is critical.

Recent research has also focused on the environmental impact of 2-(3,5-dimethylphenyl)ethanimidamide. Studies have examined its biodegradability and toxicity profiles under various conditions. These investigations are crucial for ensuring that the compound can be safely used in industrial processes without posing risks to ecosystems or human health. Preliminary findings suggest that under controlled conditions, the compound undergoes efficient biodegradation, reducing its environmental footprint.

In conclusion, 2-(3,5-dimethylphenyl)ethanimidamide (CAS No 374064-84-3) is a versatile compound with diverse applications across multiple disciplines. Its unique chemical properties make it an invaluable resource for researchers and industry professionals alike. As ongoing studies continue to uncover new insights into its potential uses and behaviors, this compound is poised to play an increasingly important role in advancing scientific and technological frontiers.

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