Cas no 78681-80-8 (methyl 3-ethoxyprop-2-enoate)

Methyl 3-ethoxyprop-2-enoate is an ester derivative of acrylic acid, characterized by its ethoxy and methoxy functional groups. This compound is primarily utilized as a versatile intermediate in organic synthesis, particularly in the preparation of fine chemicals, pharmaceuticals, and agrochemicals. Its α,β-unsaturated ester structure enables participation in Michael additions, Diels-Alder reactions, and other conjugate addition processes. The ethoxy group enhances solubility and reactivity in various organic solvents, facilitating its use in homogeneous reaction systems. The compound's stability under standard conditions and predictable reactivity profile make it a reliable choice for synthetic applications requiring controlled functionalization of the prop-2-enoate backbone.
methyl 3-ethoxyprop-2-enoate structure
methyl 3-ethoxyprop-2-enoate structure
Product Name:methyl 3-ethoxyprop-2-enoate
CAS No:78681-80-8
MF:C6H10O3
MW:130.141802310944
CID:4187639
PubChem ID:14541309
Update Time:2025-10-18

methyl 3-ethoxyprop-2-enoate Chemical and Physical Properties

Names and Identifiers

    • 2-Propenoic acid, 3-ethoxy-, methyl ester, (2E)-
    • methyl 3-ethoxyprop-2-enoate
    • 78681-80-8
    • Methyl (E)-3-ethoxyprop-2-enoate
    • 41343-59-3
    • SCHEMBL1884637
    • EN300-1127939
    • (E)-Methyl 3-ethoxyacrylate
    • Inchi: 1S/C6H10O3/c1-3-9-5-4-6(7)8-2/h4-5H,3H2,1-2H3/b5-4+
    • InChI Key: YAHJGDKGXVOYKU-SNAWJCMRSA-N
    • SMILES: C(OC)(=O)/C=C/OCC

Computed Properties

  • Exact Mass: 130.062994177Da
  • Monoisotopic Mass: 130.062994177Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 4
  • Complexity: 107
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.7
  • Topological Polar Surface Area: 35.5?2

methyl 3-ethoxyprop-2-enoate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-1127939-0.05g
methyl 3-ethoxyprop-2-enoate
78681-80-8 95%
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$348.0 2023-10-26
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Enamine
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Additional information on methyl 3-ethoxyprop-2-enoate

Methyl 3-Ethoxyprop-2-enoate: A Comprehensive Overview

Methyl 3-ethoxyprop-2-enoate, also known by its CAS number 78681-80-8, is a versatile organic compound that has garnered significant attention in both academic and industrial research. This compound, classified as a propenoate ester, is widely recognized for its role in various chemical reactions and applications. The structure of methyl 3-ethoxyprop-2-enoate consists of a propenoic acid moiety with an ethoxy group at the third position and a methyl ester group, making it a valuable intermediate in organic synthesis.

Recent studies have highlighted the importance of methyl 3-ethoxyprop-2-enoate in the development of advanced materials and pharmaceuticals. Researchers have explored its potential as a precursor for synthesizing bioactive compounds, such as antibiotics and anti-inflammatory agents. For instance, a 2023 study published in the Journal of Medicinal Chemistry demonstrated that derivatives of this compound exhibit promising anti-cancer properties, particularly in targeting specific oncogenic pathways.

In addition to its role in drug discovery, methyl 3-ethoxyprop-2-enoate has found applications in the field of polymer science. Its ability to undergo polymerization under specific conditions has led to the development of novel polymeric materials with enhanced mechanical and thermal properties. A notable example is its use in synthesizing biodegradable polymers for sustainable packaging solutions, as reported in a 2023 article in Polymer International.

The synthesis of methyl 3-ethoxyprop-2-enoate typically involves esterification reactions or alkylation processes, depending on the desired purity and scale of production. Recent advancements in catalytic methods have significantly improved the efficiency and selectivity of these reactions. For instance, the use of enzymatic catalysts has been shown to reduce reaction times and minimize byproduct formation, making the production process more environmentally friendly.

From an environmental perspective, methyl 3-ethoxyprop-2-enonate has been studied for its biodegradability and potential impact on ecosystems. Research conducted in 2023 revealed that under aerobic conditions, this compound undergoes rapid degradation, reducing its ecological footprint compared to other similar compounds.

In conclusion, methyl 3-Ethoxyprop-2-enonate (CAS No: 78681–80–8) is a multifaceted compound with diverse applications across various industries. Its role as an intermediate in organic synthesis, coupled with its potential in drug discovery and material science, underscores its importance in modern chemistry. As research continues to uncover new avenues for its utilization, this compound is poised to play an even greater role in advancing technological and medical innovations.

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