Cas no 124038-36-4 (Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester)

Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester is a specialized ester derivative of benzoic acid, incorporating a dioxolane functional group. This compound is of interest in synthetic organic chemistry due to its potential as a versatile intermediate in the preparation of more complex molecules. The presence of the dioxolane group enhances its reactivity, making it useful for protecting carbonyl functionalities or serving as a precursor in multi-step syntheses. Its ester moiety further contributes to its solubility in organic solvents, facilitating its use in various reaction conditions. The compound’s structural features make it valuable for applications in pharmaceuticals, agrochemicals, and fine chemical synthesis.
Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester structure
124038-36-4 structure
Product Name:Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester
CAS No:124038-36-4
MF:C11H12O4
MW:208.210583686829
MDL:MFCD06209425
CID:1215335
PubChem ID:19102594
Update Time:2025-10-21

Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester
    • methyl 3-(1,3-dioxolan-2-yl)benzoate
    • SCHEMBL1417028
    • 3-[1,3]Dioxolan-2-yl-benzoic acid methyl ester
    • DA-20933
    • 124038-36-4
    • Methyl 3-(1,3-dioxolan-2-yl)benzoate ,97%
    • F75411
    • DTXSID70598106
    • JMVJVYKRUJHQOI-UHFFFAOYSA-N
    • AKOS023713473
    • Methyl3-(1,3-dioxolan-2-yl)benzoate
    • AS-68637
    • MDL： MFCD06209425
    • Inchi： 1S/C11H12O4/c1-13-10(12)8-3-2-4-9(7-8)11-14-5-6-15-11/h2-4,7,11H,5-6H2,1H3
    • InChI Key： JMVJVYKRUJHQOI-UHFFFAOYSA-N
    • SMILES： O1CCOC1C1C=CC=C(C(=O)OC)C=1

Computed Properties

  • Exact Mass: 208.07356
  • Monoisotopic Mass: 208.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 223
  • 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: 1.8
  • Topological Polar Surface Area: 44.8?2

Experimental Properties

  • Density: Not available
  • Melting Point: N/A℃
  • Boiling Point: Not available
  • Flash Point: Not available
  • PSA: 44.76
  • Vapor Pressure: Not available

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Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester Pricemore >>

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Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester Suppliers

Amadis Chemical Company Limited
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(CAS:124038-36-4)Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester
Order Number:A1247246
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 22:32
Price ($):184

Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester Related Literature

Additional information on Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester

Exploring Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester (CAS No. 124038-36-4): Properties and Applications

Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester (CAS No. 124038-36-4) is a specialized organic compound that has garnered attention in the fields of synthetic chemistry and material science. This ester derivative of benzoic acid features a unique 1,3-dioxolane ring, which enhances its reactivity and versatility in various chemical reactions. Researchers and industry professionals are increasingly interested in this compound due to its potential applications in flavor and fragrance formulations, pharmaceutical intermediates, and functional materials.

The molecular structure of Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester combines the aromatic properties of benzoic acid with the cyclic acetal functionality of 1,3-dioxolane. This hybrid structure makes it a valuable building block for synthesizing more complex molecules. In recent years, the demand for such intermediates has risen, particularly in the development of green chemistry solutions and sustainable synthesis methods. The compound's stability under mild conditions and its compatibility with biodegradable polymers have also made it a subject of study in eco-friendly material research.

One of the most frequently asked questions about CAS No. 124038-36-4 revolves around its synthesis and purification. The compound is typically prepared through the esterification of 3-(1,3-dioxolan-2-yl)benzoic acid with methanol, using acid catalysts. Advanced techniques like column chromatography and recrystallization are often employed to achieve high purity, which is critical for its use in sensitive applications such as electronic materials or cosmetic formulations.

In the context of current trends, Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester aligns with the growing interest in multifunctional additives for coatings and adhesives. Its ability to act as a plasticizer or crosslinking agent has been explored in recent patents, highlighting its role in improving the durability and performance of industrial products. Additionally, its mild odor and low toxicity profile make it a candidate for replacing traditional solvents in consumer goods.

From an analytical perspective, the characterization of CAS No. 124038-36-4 involves techniques such as NMR spectroscopy, mass spectrometry, and infrared spectroscopy. These methods confirm the presence of the ester group and the dioxolane ring, ensuring the compound's identity and quality. As regulatory standards for chemical safety become stricter, such analytical data are essential for compliance with REACH and other global chemical regulations.

Looking ahead, the potential of Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester in drug delivery systems is an emerging area of research. Its biodegradability and ability to form stable complexes with active pharmaceutical ingredients (APIs) could pave the way for innovative controlled-release formulations. This aligns with the broader pharmaceutical industry's focus on patient-centric therapies and precision medicine.

In summary, Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester (CAS No. 124038-36-4) represents a fascinating intersection of chemistry and innovation. Its unique properties and adaptability to modern industrial and scientific needs make it a compound worth watching in the coming years. Whether in advanced materials, sustainable chemistry, or life sciences, its contributions are poised to grow as research continues to unlock its full potential.

124038-36-4 (Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester) Related Products

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Amadis Chemical Company Limited
(CAS:124038-36-4)Benzoic acid, 3-(1,3-dioxolan-2-yl)-, methyl ester
A1247246
Purity:99%
Quantity:1g
Price ($):184
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