Cas no 157143-20-9 (3-Ethoxy-4-methylbenzaldehyde)

3-Ethoxy-4-methylbenzaldehyde is a synthetic aromatic aldehyde characterized by its ethoxy and methyl substituents on the benzene ring. This compound is primarily utilized as an intermediate in organic synthesis, particularly in the production of pharmaceuticals, agrochemicals, and specialty chemicals. Its distinct substitution pattern enhances reactivity in condensation and substitution reactions, making it valuable for constructing complex molecular frameworks. The compound exhibits moderate stability under standard conditions and is typically handled in controlled environments to preserve its purity. Its well-defined structure and consistent performance in synthetic applications make it a reliable choice for research and industrial processes requiring precise aromatic aldehydes.
3-Ethoxy-4-methylbenzaldehyde structure
3-Ethoxy-4-methylbenzaldehyde structure
Product Name:3-Ethoxy-4-methylbenzaldehyde
CAS No:157143-20-9
MF:C10H12O2
MW:164.201083183289
MDL:MFCD18375378
CID:1091352
PubChem ID:25242058
Update Time:2025-10-30

3-Ethoxy-4-methylbenzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 3-Ethoxy-4-methylbenzaldehyde
    • 3-Ethoxy-4-methylbenzaldehyd
    • EOS-62102
    • DB-212150
    • AKOS022178325
    • IFELWTOFCUUHBY-UHFFFAOYSA-N
    • SCHEMBL1121530
    • 157143-20-9
    • CS-0196370
    • E91460
    • 3-ethoxy-4-methyl-benzaldehyde
    • Benzaldehyde, 3-ethoxy-4-methyl-
    • MDL: MFCD18375378
    • Inchi: 1S/C10H12O2/c1-3-12-10-6-9(7-11)5-4-8(10)2/h4-7H,3H2,1-2H3
    • InChI Key: IFELWTOFCUUHBY-UHFFFAOYSA-N
    • SMILES: O(CC)C1C=C(C=O)C=CC=1C

Computed Properties

  • Exact Mass: 164.08376
  • Monoisotopic Mass: 164.083729621g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 145
  • 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: 2.6
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • PSA: 26.3

3-Ethoxy-4-methylbenzaldehyde Pricemore >>

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3-Ethoxy-4-methylbenzaldehyde Related Literature

Additional information on 3-Ethoxy-4-methylbenzaldehyde

3-Ethoxy-4-methylbenzaldehyde: A Comprehensive Overview

3-Ethoxy-4-methylbenzaldehyde is a versatile aromatic aldehyde with the CAS number 157143-20-9. This compound is widely recognized in the chemical and pharmaceutical industries for its unique properties and applications. Its molecular structure, comprising a benzene ring substituted with an ethoxy group at position 3 and a methyl group at position 4, contributes to its distinctive reactivity and stability. Recent studies have highlighted its potential in various fields, including drug discovery, agrochemicals, and advanced materials.

The synthesis of 3-Ethoxy-4-methylbenzaldehyde has been optimized through innovative methodologies. Researchers have explored catalytic cross-coupling reactions, such as the Suzuki-Miyaura coupling, to enhance the efficiency of its production. These advancements have not only improved yield but also reduced environmental impact, aligning with global sustainability goals. The compound's ability to undergo further functionalization has made it a valuable intermediate in organic synthesis.

In the pharmaceutical sector, 3-Ethoxy-4-methylbenzaldehyde has shown promise as a lead compound for anti-inflammatory and anticancer drug development. Preclinical studies indicate that it exhibits selective cytotoxicity against cancer cells while minimizing effects on healthy tissues. This dual functionality underscores its potential as a targeted therapeutic agent.

Additionally, 3-Ethoxy-4-methylbenzaldehyde has found applications in agrochemicals, particularly as a precursor for bioactive compounds with pest-repellent properties. Its role in enhancing crop resilience against environmental stressors is an area of active research.

From a materials science perspective, this compound has been utilized in the development of advanced polymers and coatings. Its aromatic stability and reactivity make it an ideal candidate for creating high-performance materials with tailored properties.

Overall, 3-Ethoxy-4-methylbenzaldehyde stands out as a multifaceted compound with significant potential across diverse industries. Ongoing research continues to unlock new avenues for its application, solidifying its importance in modern chemistry.

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