Cas no 5985-26-2 (4-Acetoxyisophthalic Acid)

4-Acetoxyisophthalic Acid is a versatile organic compound with a wide range of applications in the chemical industry. It serves as a key intermediate in the synthesis of various polyesters, esters, and condensation polymers. Its structural features provide excellent compatibility with other monomers, enabling the creation of high-performance materials with desirable mechanical and thermal properties. The compound's ease of synthesis and stability make it a preferred choice for industrial applications.
4-Acetoxyisophthalic Acid structure
4-Acetoxyisophthalic Acid structure
Product Name:4-Acetoxyisophthalic Acid
CAS No:5985-26-2
MF:C10H8O6
MW:224.166923522949
CID:1059833
PubChem ID:85864100
Update Time:2025-06-20

4-Acetoxyisophthalic Acid Chemical and Physical Properties

Names and Identifiers

    • 4-Acetoxyisophthalic Acid
    • 4-(acetoxy)isophthalic acid
    • 4-Acetoxy indole
    • 4-acetoxy-1H-indole-6-carboxylic acid methyl ester
    • 4-Acetoxy-6-methoxycarbonyl-indole
    • 4-ACETOXYINDOL
    • 4-acetoxy-indole
    • 4-acetoxy-indole-6-carboxylic ac
    • 4-acetoxy-isophthalic acid
    • 4-Acetoxy-isophthalsaeure
    • 4-acetylindole
    • 4-indolyl acetate
    • AC1LBJRD
    • acetic acid 1H-indol-4-yl ester
    • acetic acid indol-4-yl ester
    • Essigsaeure-indol-4-ylester
    • PubChem7301
    • 5985-26-2
    • DB-262858
    • starbld0032041
    • 4-(acetyloxy)benzene-1,3-dicarboxylic acid
    • 4-acetyloxybenzene-1,3-dicarboxylic acid
    • Inchi: 1S/C10H8O6/c1-5(11)16-8-3-2-6(9(12)13)4-7(8)10(14)15/h2-4H,1H3,(H,12,13)(H,14,15)
    • InChI Key: MRHLSYRJOJYLSD-UHFFFAOYSA-N
    • SMILES: O(C(C)=O)C1C=CC(C(=O)O)=CC=1C(=O)O

Computed Properties

  • Exact Mass: 224.03208797g/mol
  • Monoisotopic Mass: 224.03208797g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 310
  • 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: 0.7
  • Topological Polar Surface Area: 101?2

4-Acetoxyisophthalic Acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
A189650-100mg
4-Acetoxyisophthalic Acid
5985-26-2
100mg
$ 184.00 2023-09-09
TRC
A189650-1g
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1g
$ 1455.00 2023-09-09
TRC
A189650-1000mg
4-Acetoxyisophthalic Acid
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1g
$ 1453.00 2023-04-19
A2B Chem LLC
AG72585-100mg
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$725.00 2024-04-19

Additional information on 4-Acetoxyisophthalic Acid

Introduction to 4-Acetoxyisophthalic Acid (CAS No. 5985-26-2)

4-Acetoxyisophthalic Acid (CAS No. 5985-26-2) is a versatile organic compound with a wide range of applications in the fields of chemistry, materials science, and pharmaceuticals. This compound is characterized by its unique structure, which includes an acetoxy group and two carboxylic acid groups, making it an important intermediate in the synthesis of various chemicals and materials.

The chemical formula of 4-Acetoxyisophthalic Acid is C10H8O5. It is a white crystalline solid with a molecular weight of 216.17 g/mol. The compound exhibits good thermal stability and solubility in polar solvents such as water and ethanol, which makes it suitable for various synthetic processes and applications.

In the field of materials science, 4-Acetoxyisophthalic Acid has been extensively studied for its potential use in the synthesis of advanced polymers and composites. Recent research has shown that this compound can be used as a monomer in the preparation of polyesters and polyamides with enhanced mechanical properties and thermal stability. These polymers have found applications in areas such as automotive parts, electronic components, and biomedical devices.

In the pharmaceutical industry, 4-Acetoxyisophthalic Acid has gained attention for its potential as a building block in the synthesis of novel drugs. Its unique chemical structure allows for the introduction of functional groups that can enhance the pharmacological properties of drug molecules. For instance, recent studies have explored the use of 4-Acetoxyisophthalic Acid-derived compounds in the development of anti-inflammatory agents and anticancer drugs. These compounds have shown promising results in preclinical studies, demonstrating high efficacy and low toxicity.

The synthesis of 4-Acetoxyisophthalic Acid typically involves the acetylation of isophthalic acid using acetic anhydride or acetyl chloride under controlled conditions. The reaction conditions, such as temperature, pressure, and catalysts, play a crucial role in determining the yield and purity of the final product. Recent advancements in green chemistry have led to the development of more environmentally friendly methods for synthesizing this compound, reducing waste and minimizing the use of hazardous reagents.

In addition to its synthetic applications, 4-Acetoxyisophthalic Acid has also been studied for its potential as a precursor in the synthesis of metal-organic frameworks (MOFs). MOFs are highly porous materials with a wide range of applications in gas storage, catalysis, and drug delivery. The use of 4-Acetoxyisophthalic Acid as a ligand in MOF synthesis has been shown to improve the stability and functionality of these materials.

The safety profile of 4-Acetoxyisophthalic Acid is an important consideration for its industrial use. While it is generally considered safe when handled properly, appropriate safety measures should be taken to prevent exposure to skin and eyes. It is also important to store the compound in a cool, dry place away from incompatible materials.

In conclusion, 4-Acetoxyisophthalic Acid (CAS No. 5985-26-2) is a valuable compound with diverse applications in chemistry, materials science, and pharmaceuticals. Its unique chemical structure and versatile reactivity make it an important intermediate in various synthetic processes. Ongoing research continues to explore new applications and improvements in its synthesis methods, further expanding its potential impact on these fields.

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