Cas no 41534-70-7 (ethyl N-(2-cyanophenyl)carbamate)

Ethyl N-(2-cyanophenyl)carbamate is a carbamate derivative featuring a cyano-substituted phenyl group, making it a versatile intermediate in organic synthesis. Its structure combines a carbamate functional group with an electron-withdrawing cyano substituent, enhancing reactivity in nucleophilic and electrophilic reactions. This compound is particularly useful in pharmaceutical and agrochemical research, where it serves as a precursor for heterocyclic compounds and active ingredients. Its stability under standard conditions and well-defined reactivity profile make it a reliable choice for synthetic applications. The presence of both carbamate and cyano groups allows for further functionalization, enabling the development of complex molecular architectures.
ethyl N-(2-cyanophenyl)carbamate structure
41534-70-7 structure
Product Name:ethyl N-(2-cyanophenyl)carbamate
CAS No:41534-70-7
MF:C10H10N2O2
MW:190.198602199554
MDL:MFCD08714762
CID:2826848
PubChem ID:11206279
Update Time:2025-05-19

ethyl N-(2-cyanophenyl)carbamate Chemical and Physical Properties

Names and Identifiers

    • ethyl N-(2-cyanophenyl)carbamate
    • Ethyl (2-cyanophenyl)carbamate
    • 41534-70-7
    • MFCD08714762
    • W15350
    • ethyl 2-cyanophenylcarbamate
    • ethyl-N-(2-cyanophenyl)carbamate
    • AKOS000183604
    • DTXSID00458688
    • SCHEMBL4773228
    • RJPYCQIROWUTHA-UHFFFAOYSA-N
    • (2-cyano-phenyl)-carbamic acid ethyl ester
    • Carbamic acid, (2-cyanophenyl)-, ethyl ester
    • AS-66265
    • DB-114561
    • CS-006/03883001
    • Z64438996
    • Ethyl(2-cyanophenyl)carbamate
    • CS-0216607
    • EN300-52298
    • ethyl (2-cyanophenyl)carbamate(WX191855)
    • RBA53470
    • DTXCID30409507
    • MDL： MFCD08714762
    • Inchi： 1S/C10H10N2O2/c1-2-14-10(13)12-9-6-4-3-5-8(9)7-11/h3-6H,2H2,1H3,(H,12,13)
    • InChI Key： RJPYCQIROWUTHA-UHFFFAOYSA-N
    • SMILES： O(C(NC1C=CC=CC=1C#N)=O)CC

Computed Properties

  • Exact Mass: 190.074227566g/mol
  • Monoisotopic Mass: 190.074227566g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 244
  • 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: 1.3
  • Topological Polar Surface Area: 62.1?2

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ethyl N-(2-cyanophenyl)carbamate Suppliers

Amadis Chemical Company Limited
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(CAS:41534-70-7)ethyl N-(2-cyanophenyl)carbamate
Order Number:A1183994
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 01:53
Price ($):247.0

ethyl N-(2-cyanophenyl)carbamate Related Literature

Additional information on ethyl N-(2-cyanophenyl)carbamate

Introduction to Ethyl N-(2-cyanophenyl)carbamate (CAS No. 41534-70-7)

Ethyl N-(2-cyanophenyl)carbamate, a compound with the chemical formula C9H7NO2, is a significant intermediate in the field of organic synthesis and pharmaceutical research. This compound is characterized by its ethyl carbamate moiety attached to a 2-cyanophenyl group, which imparts unique reactivity and potential applications in various chemical transformations.

The CAS No. 41534-70-7 identifier firmly classifies this molecule within the vast repository of chemical substances, facilitating its study and utilization in both academic and industrial settings. The presence of the cyano group in the phenyl ring enhances the electrophilic nature of the aromatic system, making it a valuable precursor in constructing more complex molecules.

In recent years, the interest in ethyl N-(2-cyanophenyl)carbamate has surged due to its role as a building block in drug discovery. Researchers have leveraged its structural features to develop novel therapeutic agents targeting various biological pathways. For instance, derivatives of this compound have been explored for their potential in inhibiting enzymes involved in inflammatory responses and cancer progression.

One of the most compelling aspects of ethyl N-(2-cyanophenyl)carbamate is its versatility in synthetic chemistry. The ethyl carbamate group can undergo a variety of reactions, including hydrolysis to form carboxylic acids or amidation reactions to introduce new functional groups. This adaptability has made it a staple in medicinal chemistry laboratories seeking to modify existing drug scaffolds or design entirely new molecules.

The 2-cyanophenyl moiety further enriches the synthetic possibilities by enabling cross-coupling reactions such as Suzuki-Miyaura or Buchwald-Hartwig couplings, which are pivotal for constructing biaryl structures prevalent in many bioactive compounds. These transformations have been instrumental in generating libraries of compounds for high-throughput screening, a cornerstone of modern drug discovery efforts.

Recent studies have also highlighted the importance of ethyl N-(2-cyanophenyl)carbamate in the development of agrochemicals. Its structural motif is reminiscent of certain herbicides and fungicides, suggesting that modifications could yield novel compounds with enhanced efficacy and environmental safety profiles. Such applications underscore the compound's broad utility beyond pharmaceuticals.

The synthesis of ethyl N-(2-cyanophenyl)carbamate typically involves the reaction of 2-cyanophenylamine with diethyl carbonate under controlled conditions. This process highlights the compound's synthetic accessibility, which is crucial for both research and industrial-scale production. Advances in catalytic systems have further refined these synthetic routes, improving yields and reducing byproduct formation.

In conclusion, ethyl N-(2-cyanophenyl)carbamate (CAS No. 41534-70-7) represents a fascinating intersection of organic chemistry and medicinal science. Its unique structural features and reactivity make it a valuable tool for researchers aiming to develop innovative therapeutic agents and functional materials. As our understanding of biological systems evolves, it is likely that this compound will continue to play a pivotal role in shaping future advancements.

41534-70-7 (ethyl N-(2-cyanophenyl)carbamate) Related Products

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Amadis Chemical Company Limited
(CAS:41534-70-7)ethyl N-(2-cyanophenyl)carbamate
A1183994
Purity:99%
Quantity:1g
Price ($):247.0
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