Cas no 3265-74-5 (2-Methylbenzofuran-3-carboxylic acid)

2-Methylbenzofuran-3-carboxylic acid is a heterocyclic organic compound featuring a benzofuran core substituted with a methyl group at the 2-position and a carboxylic acid moiety at the 3-position. This structure imparts reactivity suitable for use as an intermediate in pharmaceutical and agrochemical synthesis. The carboxylic acid group enables further functionalization through esterification, amidation, or other derivatization reactions, while the benzofuran scaffold contributes to its utility in constructing biologically active molecules. Its well-defined chemical properties and stability under standard conditions make it a reliable building block for research and industrial applications. The compound is typically handled under controlled conditions to ensure purity and consistency in synthetic workflows.
2-Methylbenzofuran-3-carboxylic acid structure
3265-74-5 structure
Product Name:2-Methylbenzofuran-3-carboxylic acid
CAS No:3265-74-5
MF:C10H8O3
MW:176.168723106384
CID:1110891
PubChem ID:10942979
Update Time:2025-05-19

2-Methylbenzofuran-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2-methyl-3-Benzofurancarboxylic acid
    • 2-Methyl-benzofuran-3-carbonsaure
    • SCHEMBL1398779
    • DB-356153
    • EN300-118458
    • 2-methylbenzofuran-3-carboxylic Acid
    • 3-Benzofurancarboxylic acid, 2-methyl-
    • 3265-74-5
    • MFCD01555114
    • Oprea1_600582
    • D78673
    • 2-methyl-1-benzofuran-3-carboxylic acid
    • AKOS006277615
    • Z1198157052
    • SY146621
    • 2-methylbenzofuran-3-carboxylicAcid
    • 2-Methylbenzofuran-3-carboxylic acid
    • Inchi: 1S/C10H8O3/c1-6-9(10(11)12)7-4-2-3-5-8(7)13-6/h2-5H,1H3,(H,11,12)
    • InChI Key: QNMGYGHSTHUNJI-UHFFFAOYSA-N
    • SMILES: O1C(C)=C(C(=O)O)C2C=CC=CC1=2

Computed Properties

  • Exact Mass: 176.047344113g/mol
  • Monoisotopic Mass: 176.047344113g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 214
  • 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: 2.3
  • Topological Polar Surface Area: 50.4?2

Experimental Properties

  • Color/Form: No data avaiable
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 336.4±22.0 °C at 760 mmHg
  • Flash Point: 157.3±22.3 °C
  • Vapor Pressure: 0.0±0.8 mmHg at 25°C

2-Methylbenzofuran-3-carboxylic acid Security Information

2-Methylbenzofuran-3-carboxylic acid Pricemore >>

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Additional information on 2-Methylbenzofuran-3-carboxylic acid

2-Methylbenzofuran-3-carboxylic Acid: A Comprehensive Overview

2-Methylbenzofuran-3-carboxylic acid (CAS No. 3265-74-5) is a compound of significant interest in the fields of organic chemistry, pharmacology, and materials science. This compound, also referred to as MBFCA or methylbenzofuran carboxylic acid, has garnered attention due to its unique structural properties and potential applications in drug development and advanced materials.

The molecular structure of 2-Methylbenzofuran-3-carboxylic acid consists of a benzofuran ring system with a methyl group at the 2-position and a carboxylic acid group at the 3-position. This arrangement imparts the compound with both aromatic and heterocyclic characteristics, making it a versatile building block for various chemical transformations. Recent studies have highlighted its role as a precursor in the synthesis of bioactive molecules, particularly in the development of anti-inflammatory and antioxidant agents.

One of the most notable advancements involving MBFCA is its application in medicinal chemistry. Researchers have explored its ability to act as a scaffold for designing novel drugs targeting neurodegenerative diseases such as Alzheimer's and Parkinson's. The compound's unique electronic properties allow for efficient binding to specific protein targets, making it a promising candidate for drug discovery pipelines.

In addition to its pharmacological applications, 2-Methylbenzofuran-3-carboxylic acid has been investigated for its potential in materials science. Its aromaticity and conjugated system make it suitable for use in organic electronics, particularly in the development of semiconducting polymers and organic light-emitting diodes (OLEDs). Recent breakthroughs have demonstrated that derivatives of this compound can significantly enhance the efficiency and stability of OLED devices, paving the way for next-generation display technologies.

The synthesis of MBFCA has also been optimized in recent years, with green chemistry approaches gaining prominence. Traditional methods often involved multi-step reactions with harsh conditions, but modern techniques now employ catalytic systems that reduce environmental impact while maintaining high yields. These advancements not only make the compound more accessible but also align with global sustainability goals.

From an analytical standpoint, 2-Methylbenzofuran-3-carboxylic acid has been extensively studied using advanced spectroscopic techniques such as NMR and IR spectroscopy. These studies have provided deeper insights into its molecular interactions and reactivity, further enhancing its utility in both academic research and industrial applications.

In conclusion, MBFCA stands out as a multifaceted compound with diverse applications across various scientific domains. Its structural versatility, combined with cutting-edge research findings, positions it as a key player in future innovations within medicine, materials science, and beyond.

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