Cas no 119580-85-7 (methyl 4-ethenyl-1-methyl-1H-pyrrole-2-carboxylate)

Methyl 4-ethenyl-1-methyl-1H-pyrrole-2-carboxylate is a versatile pyrrole derivative with applications in organic synthesis and pharmaceutical research. Its structure features a reactive ethenyl group and an ester functionality, enabling further derivatization through cross-coupling, polymerization, or nucleophilic substitution reactions. The compound serves as a valuable intermediate in the development of heterocyclic compounds, agrochemicals, and bioactive molecules. Its stability under standard conditions and compatibility with common organic solvents enhance its utility in laboratory-scale and industrial processes. The methyl ester group offers synthetic flexibility, allowing hydrolysis or transesterification for downstream modifications. This compound is particularly useful in constructing complex pyrrole-based frameworks for medicinal chemistry and materials science applications.
methyl 4-ethenyl-1-methyl-1H-pyrrole-2-carboxylate structure
119580-85-7 structure
Product Name:methyl 4-ethenyl-1-methyl-1H-pyrrole-2-carboxylate
CAS No:119580-85-7
MF:C9H11NO2
MW:165.189142465591
CID:133103
PubChem ID:14173861
Update Time:2025-08-04

methyl 4-ethenyl-1-methyl-1H-pyrrole-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrrole-2-carboxylicacid, 4-ethenyl-1-methyl-, methyl ester
    • 1H-Pyrrole-2-carboxylicacid,4-ethenyl-1-methyl-,methylester(9CI)
    • methyl 4-ethenyl-1-methyl-1H-pyrrole-2-carboxylate
    • 119580-85-7
    • SCHEMBL13341456
    • DTXSID901227179
    • EN300-1853253
    • Methyl 1-methyl-4-vinyl-1H-pyrrole-2-carboxylate
    • METHYL 4-ETHENYL-1-METHYLPYRROLE-2-CARBOXYLATE
    • Inchi: 1S/C9H11NO2/c1-4-7-5-8(9(11)12-3)10(2)6-7/h4-6H,1H2,2-3H3
    • InChI Key: SOMZYAUOXLOPIH-UHFFFAOYSA-N
    • SMILES: O(C)C(C1=CC(C=C)=CN1C)=O

Computed Properties

  • Exact Mass: 165.078978594g/mol
  • Monoisotopic Mass: 165.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 191
  • 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: 31.2?2

methyl 4-ethenyl-1-methyl-1H-pyrrole-2-carboxylate Pricemore >>

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Additional information on methyl 4-ethenyl-1-methyl-1H-pyrrole-2-carboxylate

Methyl 4-Ethenyl-1-Methyl-1H-Pyrrole-2-Carboxylate: A Comprehensive Overview

Methyl 4-Ethenyl-1-Methyl-1H-Pyrrole-2-Carboxylate, also known by its CAS number 119580-85-7, is a fascinating compound with significant applications in various fields of chemistry and materials science. This compound, characterized by its unique structure, has garnered attention due to its potential in drug development, polymer synthesis, and as a precursor for advanced materials.

The molecular structure of methyl 4-ethenyl-1-methyl-1H-pyrrole-2-carboxylate comprises a pyrrole ring substituted with an ethenyl group at the 4-position and a methyl group at the 2-position, along with a carboxylate ester functional group. This combination of substituents imparts the compound with versatile chemical properties, making it suitable for a wide range of applications.

Recent studies have highlighted the potential of this compound in the development of novel pharmaceutical agents. Researchers have explored its role as a building block for bioactive molecules, particularly in the synthesis of antiviral and anticancer agents. The presence of the pyrrole ring, a common feature in many biologically active compounds, contributes to its promising pharmacological profile.

In the realm of materials science, methyl 4-ethenyl-1-methyl-1H-pyrrole-2-carboxylate has been utilized as a monomer in the synthesis of functional polymers. Its ability to undergo polymerization under specific conditions has led to the creation of materials with tailored properties, such as high thermal stability and mechanical strength. These polymers find applications in advanced composites and high-performance coatings.

The synthesis of this compound involves a series of well-established organic reactions, including alkylation, esterification, and cyclization processes. Recent advancements in catalytic methods have enabled more efficient and selective syntheses, reducing production costs and enhancing product purity.

From an environmental perspective, studies have been conducted to assess the biodegradability and eco-friendliness of methyl 4-ethenyl-1-methyl-1H-pyrrole-2-carboxylate. Findings indicate that under specific conditions, the compound can undergo microbial degradation, making it a more sustainable option for industrial applications.

Looking ahead, ongoing research is focused on expanding the scope of applications for this compound. Potential areas include its use in electronic materials, such as conductive polymers and organic semiconductors, where its electronic properties could be harnessed for next-generation devices.

In conclusion, methyl 4-Ethenyl-1-Methyl-1H-Pyrrole-2-Carboxylate stands out as a multifaceted compound with immense potential across diverse industries. Its unique structure and versatile chemical properties continue to drive innovative research and development efforts worldwide.

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