Cas no 64779-08-4 (4-(4-Hexylphenyl)-4-oxobutyric acid)

4-(4-Hexylphenyl)-4-oxobutyric acid is a specialized organic compound featuring a hexylphenyl group linked to a 4-oxobutyric acid moiety. This structure imparts unique physicochemical properties, making it valuable in synthetic chemistry and material science applications. Its aromatic and aliphatic components contribute to solubility in both polar and nonpolar solvents, enhancing versatility in reaction conditions. The ketone and carboxylic acid functional groups offer reactive sites for further derivatization, enabling its use as an intermediate in pharmaceuticals, liquid crystals, or advanced polymers. The hexyl chain provides lipophilicity, which can be advantageous in designing hydrophobic materials or bioactive molecules. This compound is characterized by its stability and well-defined reactivity profile.
4-(4-Hexylphenyl)-4-oxobutyric acid structure
64779-08-4 structure
Product Name:4-(4-Hexylphenyl)-4-oxobutyric acid
CAS No:64779-08-4
MF:C16H22O3
MW:262.344085216522
CID:501193
PubChem ID:2801473
Update Time:2025-11-02

4-(4-Hexylphenyl)-4-oxobutyric acid Chemical and Physical Properties

Names and Identifiers

    • 3-(4-Hexylbenzoyl)-propionic acid
    • 4-(4-Hexylphenyl)-4-oxobutanoic acid
    • 4-(4-Hexylphenyl)-4-oxobutyric acid
    • AKOS016022765
    • CCG-236323
    • 4-(4-hexylphenyl)-4-oxobutanoicacid
    • MFCD00173762
    • SCHEMBL3130654
    • DTXSID00384256
    • 64779-08-4
    • MDL: MFCD00173762
    • Inchi: 1S/C16H22O3/c1-2-3-4-5-6-13-7-9-14(10-8-13)15(17)11-12-16(18)19/h7-10H,2-6,11-12H2,1H3,(H,18,19)
    • InChI Key: WWHKOZXEVDESBN-UHFFFAOYSA-N
    • SMILES: O=C(CCC(=O)O)C1C=CC(=CC=1)CCCCCC

Computed Properties

  • Exact Mass: 262.15696
  • Monoisotopic Mass: 262.15689456g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 9
  • Complexity: 278
  • 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: 4.5
  • Topological Polar Surface Area: 54.4?2

Experimental Properties

  • Density: 1.06
  • Boiling Point: 440.7°C at 760 mmHg
  • Flash Point: 234.4°C
  • Refractive Index: 1.519
  • PSA: 54.37

4-(4-Hexylphenyl)-4-oxobutyric acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
H082610-250mg
4-(4-Hexylphenyl)-4-oxobutyric acid
64779-08-4
250mg
$ 440.00 2022-06-04
TRC
H082610-500mg
4-(4-Hexylphenyl)-4-oxobutyric acid
64779-08-4
500mg
$ 735.00 2022-06-04
Fluorochem
207372-1g
4-(4-Hexylphenyl)-4-oxobutyric acid
64779-08-4 97%
1g
£424.00 2022-03-01
Fluorochem
207372-2g
4-(4-Hexylphenyl)-4-oxobutyric acid
64779-08-4 97%
2g
£716.00 2022-03-01
Fluorochem
207372-5g
4-(4-Hexylphenyl)-4-oxobutyric acid
64779-08-4 97%
5g
£1753.00 2022-03-01
A2B Chem LLC
AG95756-1g
4-(4-Hexylphenyl)-4-oxobutanoic acid
64779-08-4 97%
1g
$516.00 2024-04-19
A2B Chem LLC
AG95756-2g
4-(4-Hexylphenyl)-4-oxobutanoic acid
64779-08-4 97%
2g
$839.00 2024-04-19
A2B Chem LLC
AG95756-5g
4-(4-Hexylphenyl)-4-oxobutanoic acid
64779-08-4 97%
5g
$1989.00 2024-04-19
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1645296-1g
4-(4-Hexylphenyl)-4-oxobutanoic acid
64779-08-4 98%
1g
¥6058.00 2024-05-05
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1645296-2g
4-(4-Hexylphenyl)-4-oxobutanoic acid
64779-08-4 98%
2g
¥8173.00 2024-05-05

Additional information on 4-(4-Hexylphenyl)-4-oxobutyric acid

Comprehensive Guide to 4-(4-Hexylphenyl)-4-oxobutyric acid (CAS No. 64779-08-4): Properties, Applications, and Market Insights

4-(4-Hexylphenyl)-4-oxobutyric acid (CAS No. 64779-08-4) is an organic compound with significant applications in pharmaceuticals, materials science, and specialty chemicals. This comprehensive guide explores its chemical properties, synthesis methods, industrial uses, and emerging trends. As researchers increasingly focus on sustainable chemical synthesis and bioactive intermediates, this compound has gained attention for its unique structural features and versatile reactivity.

The molecular structure of 4-(4-Hexylphenyl)-4-oxobutyric acid combines an aromatic ring with a flexible aliphatic chain and a reactive carboxyl group. This combination makes it valuable for creating liquid crystal materials, pharmaceutical intermediates, and specialty polymers. Recent studies highlight its potential in drug discovery, particularly as a building block for compounds targeting metabolic disorders and inflammatory conditions.

From a technical perspective, 4-(4-Hexylphenyl)-4-oxobutyric acid demonstrates interesting physicochemical properties. The compound typically appears as a white to off-white crystalline powder with moderate solubility in organic solvents. Its thermal stability and melting point range make it suitable for various industrial processes. Analytical characterization typically involves HPLC analysis, mass spectrometry, and NMR spectroscopy to ensure purity and confirm structural integrity.

The synthesis of 4-(4-Hexylphenyl)-4-oxobutyric acid (CAS 64779-08-4) generally involves multi-step organic reactions starting from readily available precursors. Modern synthetic approaches emphasize green chemistry principles, including catalyst optimization and solvent selection to minimize environmental impact. These advancements align with growing industry demands for eco-friendly production methods and reduced carbon footprint in chemical manufacturing.

In pharmaceutical applications, this compound serves as a key intermediate for developing targeted therapies. Its structural features allow for diverse modifications, making it valuable in medicinal chemistry research. Recent patent literature reveals its use in developing compounds with potential anti-diabetic and anti-inflammatory properties, addressing some of today's most pressing healthcare challenges.

The materials science field has also benefited from 4-(4-Hexylphenyl)-4-oxobutyric acid. Its incorporation into advanced polymer systems enhances material properties such as thermal stability and mechanical strength. Researchers are exploring its use in smart materials and functional coatings, particularly where controlled release or specific surface interactions are desired.

Market analysis indicates steady growth in demand for 4-(4-Hexylphenyl)-4-oxobutyric acid across multiple industries. The compound's versatility supports its use in high-value chemical products, with particular expansion in the Asia-Pacific region. Quality standards and regulatory compliance remain critical factors for manufacturers, especially when producing material for pharmaceutical-grade applications.

Storage and handling recommendations for 4-(4-Hexylphenyl)-4-oxobutyric acid emphasize standard laboratory precautions. The compound should be kept in airtight containers away from moisture and extreme temperatures. Proper personal protective equipment should be used when handling the powder form to prevent inhalation or skin contact.

Future research directions for 4-(4-Hexylphenyl)-4-oxobutyric acid (CAS 64779-08-4) include exploring its potential in nanotechnology applications and bioconjugation chemistry. The compound's unique structure offers opportunities for creating novel drug delivery systems and biocompatible materials. These developments align with broader trends toward personalized medicine and advanced material design.

For researchers and industry professionals seeking detailed technical information about 4-(4-Hexylphenyl)-4-oxobutyric acid, comprehensive data sheets are available from specialty chemical suppliers. These typically include spectroscopic data, purity specifications, and safety information. As with any chemical substance, proper risk assessment should precede laboratory use or industrial application.

The environmental profile of 4-(4-Hexylphenyl)-4-oxobutyric acid has become an important consideration in recent years. Studies focus on its biodegradability and ecotoxicological impact, particularly as regulatory requirements for chemical substances become more stringent worldwide. These evaluations help ensure sustainable use of this valuable chemical intermediate across various applications.

Analytical method development for 4-(4-Hexylphenyl)-4-oxobutyric acid continues to advance, with new techniques enabling more precise quality control and impurity profiling. Modern chromatographic methods coupled with advanced detection systems provide comprehensive characterization essential for pharmaceutical and high-tech applications where purity standards are critical.

In conclusion, 4-(4-Hexylphenyl)-4-oxobutyric acid (CAS No. 64779-08-4) represents an important chemical building block with diverse applications. Its significance spans pharmaceutical development, advanced materials, and specialty chemicals, with ongoing research uncovering new potential uses. As chemical innovation progresses, this compound will likely maintain its relevance in scientific and industrial contexts, particularly in developing solutions for healthcare and technology challenges.

Recommended suppliers
Shanghai Aoguang Biotechnology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Aoguang Biotechnology Co., Ltd
Nanjing Jubai Biopharm
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nanjing Jubai Biopharm
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Jinan Hanyu Chemical Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinan Hanyu Chemical Co.,Ltd.
Enjia Trading Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Enjia Trading Co., Ltd