Cas no 36685-97-9 (Benzoic acid, decylester)

Benzoic acid decylester, also known as decyl benzoate, is an ester derived from benzoic acid and decyl alcohol. This compound is characterized by its clear, colorless appearance and mild aromatic odor. It exhibits excellent solubility in organic solvents and low volatility, making it suitable for use as a high-boiling solvent or plasticizer in various industrial applications. Its chemical stability and compatibility with polymers contribute to its utility in coatings, adhesives, and personal care formulations. Additionally, decyl benzoate demonstrates good emollient properties, enhancing its role in cosmetic and pharmaceutical products. Its low irritation potential further supports its use in sensitive applications.
Benzoic acid, decylester structure
Benzoic acid, decylester structure
Product Name:Benzoic acid, decylester
CAS No:36685-97-9
MF:C17H26O2
MW:262.387145519257
MDL:MFCD30470097
CID:318258
PubChem ID:100496
Update Time:2025-06-08

Benzoic acid, decylester Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, decylester
    • decyl benzoate
    • n-decyl benzoate
    • V3CDC8WE5M
    • DTXSID40190131
    • AS-76938
    • EINECS 253-157-4
    • AI3-08512
    • SCHEMBL1037965
    • starbld0039347
    • NSC 309829
    • D93456
    • 36685-97-9
    • NS00030078
    • NSC309829
    • Decyl alcohol, benzoate
    • NSC-309829
    • Benzoic acid decyl ester
    • Benzoic acid, decyl ester
    • MDL: MFCD30470097
    • Inchi: 1S/C17H26O2/c1-2-3-4-5-6-7-8-12-15-19-17(18)16-13-10-9-11-14-16/h9-11,13-14H,2-8,12,15H2,1H3
    • InChI Key: CUSUFTNOPPMGBK-UHFFFAOYSA-N
    • SMILES: O(C(C1C=CC=CC=1)=O)CCCCCCCCCC

Computed Properties

  • Exact Mass: 262.19338
  • Monoisotopic Mass: 262.193
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 11
  • Complexity: 219
  • 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: 6.8
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • Density: 0.951
  • Boiling Point: 353°Cat760mmHg
  • Flash Point: 149°C
  • Refractive Index: 1.489
  • PSA: 26.3

Benzoic acid, decylester Pricemore >>

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Benzoic acid, decylester Related Literature

Additional information on Benzoic acid, decylester

Benzoic Acid, Decylester: A Comprehensive Overview

Benzoic acid, decylester, also known by its CAS number 36685-97-9, is a versatile organic compound with a wide range of applications across various industries. This compound is derived from the esterification of benzoic acid with decanol, resulting in a molecule that combines the aromatic properties of benzoic acid with the hydrophobic characteristics of a long alkyl chain. The structure of benzoic acid, decylester makes it particularly useful in applications where both solubility and stability are critical factors.

The synthesis of benzoic acid, decylester typically involves an esterification reaction between benzoic acid and decanol in the presence of an acid catalyst. This process can be optimized to achieve high yields and purity levels, which are essential for its use in sensitive applications such as pharmaceuticals and cosmetics. Recent advancements in catalytic systems have enabled more efficient and environmentally friendly production methods, reducing the overall carbon footprint associated with its manufacturing.

Benzoic acid, decylester finds extensive use in the cosmetic industry as an emulsifier and stabilizer. Its ability to form stable emulsions makes it ideal for products such as lotions, creams, and shampoos. Additionally, it is employed as a fragrance ingredient due to its capacity to dissolve and release volatile aromatic compounds slowly over time. In the food industry, it serves as a preservative and flavor enhancer, contributing to the shelf life and sensory properties of various food products.

In recent years, there has been growing interest in exploring the potential of benzoic acid, decylester in biomedical applications. Studies have shown that it can act as a drug delivery vehicle due to its biocompatibility and controlled release properties. Researchers are investigating its use in targeted drug delivery systems, where it can encapsulate therapeutic agents and release them gradually at specific sites within the body. This application holds promise for improving treatment efficacy while minimizing side effects.

The environmental impact of benzoic acid, decylester has also been a topic of recent research. Biodegradation studies indicate that it is readily broken down by microorganisms under aerobic conditions, making it less persistent in the environment compared to some other synthetic compounds. However, further studies are needed to fully understand its long-term ecological effects and to develop strategies for minimizing its environmental footprint.

In conclusion, benzoic acid, decylester, with its unique chemical properties and diverse applications, continues to be a significant compound in various industrial sectors. Ongoing research is focused on enhancing its production efficiency, expanding its application scope, and ensuring its environmental sustainability. As new findings emerge, this compound is expected to play an even more prominent role in meeting the evolving needs of modern industries while adhering to stringent safety and regulatory standards.

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