Cas no 5110-77-0 (2-Chloro-N,2-diphenylacetamide)

2-Chloro-N,2-diphenylacetamide is a chlorinated acetamide derivative characterized by its phenyl-substituted structure. This compound is primarily utilized as an intermediate in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. Its reactive chloro and amide functional groups enable versatile transformations, such as nucleophilic substitutions and condensation reactions. The diphenyl substitution enhances steric and electronic properties, influencing reactivity and selectivity in synthetic pathways. The compound is typically handled under controlled conditions due to its potential sensitivity to moisture and heat. Its well-defined structure and purity make it a valuable building block for researchers in medicinal and industrial chemistry applications.
2-Chloro-N,2-diphenylacetamide structure
5110-77-0 structure
Product Name:2-Chloro-N,2-diphenylacetamide
CAS No:5110-77-0
MF:C14H12ClNO
MW:245.704182624817
MDL:MFCD00439017
CID:1075009
PubChem ID:3582841
Update Time:2025-06-12

2-Chloro-N,2-diphenylacetamide Chemical and Physical Properties

Names and Identifiers

    • 2-Chloro-N,2-diphenylacetamide
    • 1-phenyl-1-chloroacetanilide
    • 2-chloro-2-phenyl-N-phenylacetamide
    • 2-chloro-N,2-diphenyl-acetamide
    • AC1MSDYU
    • AC1Q3GEW
    • chloro-phenyl-acetic acid anilide
    • Chlor-phenyl-essigsaeure-anilid
    • CTK4J3641
    • Z169917702
    • AKOS001288150
    • DTXSID90393877
    • AKOS017259279
    • SCHEMBL10465216
    • A918465
    • 5110-77-0
    • benzeneacetamide, alpha-chloro-N-phenyl-
    • 2-Chloro-2,N-diphenyl-acetamide
    • G35072
    • MFCD00439017
    • ALBB-018925
    • EN300-24240
    • MDL: MFCD00439017
    • Inchi: 1S/C14H12ClNO/c15-13(11-7-3-1-4-8-11)14(17)16-12-9-5-2-6-10-12/h1-10,13H,(H,16,17)
    • InChI Key: FMADJSSGSBCKGZ-UHFFFAOYSA-N
    • SMILES: ClC(C(NC1C=CC=CC=1)=O)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 245.06086
  • Monoisotopic Mass: 245.0607417g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 245
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.4
  • Topological Polar Surface Area: 29.1?2

Experimental Properties

  • Density: 1.3±0.1 g/cm3
  • Melting Point: 150-152 °C
  • Boiling Point: 434.7±38.0 °C at 760 mmHg
  • Flash Point: 216.7±26.8 °C
  • PSA: 29.1
  • Vapor Pressure: 0.0±1.0 mmHg at 25°C

2-Chloro-N,2-diphenylacetamide Security Information

2-Chloro-N,2-diphenylacetamide Pricemore >>

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Additional information on 2-Chloro-N,2-diphenylacetamide

Professional Introduction to 2-Chloro-N,2-diphenylacetamide (CAS No. 5110-77-0)

2-Chloro-N,2-diphenylacetamide, identified by the chemical compound code CAS No. 5110-77-0, is a significant molecule in the realm of pharmaceutical chemistry and organic synthesis. This compound, characterized by its 2-chloro-N,2-diphenylacetamide structure, has garnered considerable attention due to its versatile applications in medicinal chemistry and industrial processes. The presence of both chloro and phenyl groups in its molecular framework imparts unique reactivity and functional properties, making it a valuable intermediate in the synthesis of various pharmacologically active agents.

The chemical formula of 2-Chloro-N,2-diphenylacetamide can be represented as C14H12ClNO. This molecular composition underscores its role as a building block in the construction of more complex chemical entities. The amide functional group and the electron-withdrawing nature of the chloro substituent contribute to its reactivity, enabling it to participate in a wide array of chemical transformations. These transformations are crucial for the development of novel therapeutic agents that target diverse biological pathways.

In recent years, the pharmaceutical industry has witnessed a surge in the exploration of heterocyclic compounds, which often serve as key structural motifs in drug molecules. 2-Chloro-N,2-diphenylacetamide fits seamlessly into this landscape due to its ability to form stable heterocyclic frameworks when subjected to appropriate reaction conditions. Researchers have leveraged its structural features to develop derivatives that exhibit enhanced biological activity. For instance, modifications at the amide bond or the phenyl rings can lead to compounds with improved pharmacokinetic profiles or altered target specificity.

The synthesis of 2-Chloro-N,2-diphenylacetamide typically involves multi-step organic reactions that require precise control over reaction conditions. Common synthetic routes include chlorination of diphenylacetamide or condensation reactions involving chlorinated precursors. The efficiency and scalability of these synthetic methodologies are critical for industrial applications, where large quantities of high-purity material are often required. Advances in catalytic systems and green chemistry principles have further refined these synthetic pathways, making them more sustainable and cost-effective.

The applications of 2-Chloro-N,2-diphenylacetamide extend beyond pharmaceuticals into other areas such as agrochemicals and specialty chemicals. Its structural versatility allows it to serve as a precursor for compounds that exhibit herbicidal or pesticidal properties. Additionally, its role in material science cannot be overlooked, where it contributes to the development of advanced polymers and coatings with tailored properties.

Recent studies have highlighted the potential of 2-Chloro-N,2-diphenylacetamide in the development of antiviral and anticancer agents. The compound's ability to interact with biological targets at a molecular level makes it an attractive candidate for drug discovery efforts. For instance, derivatives of this molecule have been investigated for their ability to inhibit enzymes involved in viral replication or cancer cell proliferation. These findings underscore the importance of continued research into this class of compounds.

The regulatory landscape surrounding 2-Chloro-N,2-diphenylacetamide is governed by agencies such as the U.S. Food and Drug Administration (FDA) and the European Medicines Agency (EMA). Compliance with these regulatory requirements ensures that any products derived from this compound meet stringent safety and efficacy standards before they reach the market. Manufacturers must adhere to Good Manufacturing Practices (GMP) and conduct rigorous toxicological studies to assess potential risks associated with their use.

In conclusion, 2-Chloro-N,2-diphenylacetamide (CAS No. 5110-77-0) is a multifaceted compound with significant implications in pharmaceuticals and beyond. Its unique structural features enable it to participate in diverse chemical reactions, making it a valuable intermediate in synthetic chemistry. The ongoing research into its derivatives continues to uncover new applications across various industries, reinforcing its importance as a cornerstone molecule in modern chemical research.

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