Cas no 617-53-8 (Dimethyl Mesaconate)

Dimethyl Mesaconate structure
Dimethyl Mesaconate structure
Product Name:Dimethyl Mesaconate
CAS No:617-53-8
MF:C7H10O4
MW:158.151902675629
CID:955053
PubChem ID:5280755
Update Time:2025-10-29

Dimethyl Mesaconate Chemical and Physical Properties

Names and Identifiers

    • dimethyl mesaconate
    • 2-Methylfumaric acid dimethyl ester
    • Methylfumaric acid, dimethyl ester
    • WQEXBUQDXKPVHR-SNAWJCMRSA-
    • 1,4-dimethyl (2Z)-2-methylbut-2-enedioate
    • trans-2-methyl-but-2-enoic acid dimethyl ester
    • Citraconic acid dimethyl ester
    • CHEBI:4607
    • EN300-1387339
    • dimethyl 2-methylfumarate
    • DTXSID201031523
    • NSC-226153
    • 2-Butenedioic acid, 2-methyl-, dimethyl ester, (Z)-
    • Citraconate de dimethyle
    • 1,4-dimethyl (2E)-2-methylbut-2-enedioate
    • 2-Methyl-but-2-enedioic acid dimethyl ester, E
    • Dimethyl (2E)-2-methyl-2-butenedioate
    • SCHEMBL5953576
    • 617-53-8
    • MFCD00059306
    • (E)-2-Methyl-2-butenedioic acid, dimethyl ester
    • Dimethyl citraconate
    • DIMETHYL-CITRACONATE
    • 617-54-9
    • 84569-14-2
    • Dimethyl methylmaleate
    • LMFA07010836
    • dimethyl (E)-2-methylbut-2-enedioate
    • InChI=1/C7H10O4/c1-5(7(9)11-3)4-6(8)10-2/h4H,1-3H3/b5-4+
    • 2-Methyl-but-2-enedioic acid dimethyl ester
    • Mesaconic acid, dimethyl ester
    • (2E)-Dimethyl 2-methylfumarate
    • C05126
    • Q27106419
    • NSC226153
    • SCHEMBL7771274
    • Dimethyl Mesaconate
    • Inchi: 1S/C7H10O4/c1-5(7(9)11-3)4-6(8)10-2/h4H,1-3H3/b5-4+
    • InChI Key: WQEXBUQDXKPVHR-SNAWJCMRSA-N
    • SMILES: COC(/C=C(/C(OC)=O)\C)=O

Computed Properties

  • Exact Mass: 158.05800
  • Monoisotopic Mass: 158.05790880g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 4
  • Complexity: 193
  • 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: 0.6
  • Topological Polar Surface Area: 52.6?2

Experimental Properties

  • Density: 1.0914
  • Boiling Point: 203.5°C (estimate)
  • Refractive Index: 1.4512 (estimate)
  • PSA: 52.60000
  • LogP: 0.27870

Dimethyl Mesaconate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
D447480-250mg
Dimethyl Mesaconate
617-53-8
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$ 85.00 2022-01-09
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Enamine
EN300-1387339-1.0g
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Aaron
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Additional information on Dimethyl Mesaconate

Dimethyl Mesaconate (CAS No. 617-53-8): Properties, Applications, and Market Insights

Dimethyl Mesaconate (CAS No. 617-53-8) is an organic compound belonging to the class of ester derivatives. It is widely recognized for its role in organic synthesis and industrial applications. This compound is particularly valued for its versatility in chemical reactions, making it a key intermediate in the production of various specialty chemicals.

The chemical structure of Dimethyl Mesaconate features a mesaconate backbone with two methyl ester groups, which contribute to its reactivity and solubility in organic solvents. Researchers and manufacturers often utilize this compound in polymer chemistry, pharmaceutical intermediates, and flavor and fragrance applications. Its stability under controlled conditions makes it a preferred choice for laboratory-scale synthesis and industrial processes.

One of the trending topics in the chemical industry is the demand for sustainable and bio-based chemicals. Dimethyl Mesaconate aligns with this trend, as it can be derived from renewable resources through fermentation processes. This aspect has garnered attention from companies focusing on green chemistry and eco-friendly production methods. Additionally, its potential use in biodegradable polymers has sparked interest among researchers exploring alternatives to conventional plastics.

In the pharmaceutical sector, Dimethyl Mesaconate serves as a building block for synthesizing active pharmaceutical ingredients (APIs). Its ability to undergo esterification and condensation reactions makes it valuable for creating complex molecular structures. Recent studies have also investigated its role in drug delivery systems, particularly in enhancing the bioavailability of certain compounds.

The global market for Dimethyl Mesaconate is influenced by factors such as research and development activities, regulatory policies, and the growing demand for high-performance materials. Companies specializing in fine chemicals and custom synthesis are actively exploring its commercial potential. Furthermore, the rise of AI-driven chemical discovery has accelerated the identification of new applications for this compound, making it a subject of interest in computational chemistry.

For those seeking Dimethyl Mesaconate suppliers, it is essential to consider factors such as purity levels, packaging options, and regulatory compliance. The compound is typically available in laboratory and bulk quantities, catering to both academic research and industrial-scale production. As the chemical industry evolves, Dimethyl Mesaconate continues to demonstrate its relevance in advancing scientific innovation and technological progress.

In summary, Dimethyl Mesaconate (CAS No. 617-53-8) is a multifaceted compound with applications spanning organic synthesis, pharmaceuticals, and sustainable materials. Its unique properties and adaptability position it as a valuable component in modern chemistry. Whether you are a researcher, manufacturer, or industry professional, understanding the potential of this compound can open doors to new opportunities in chemical innovation.

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