Cas no 16386-97-3 (2-cyclohexyl-2-methylpropanoic acid)

2-Cyclohexyl-2-methylpropanoic acid is a cycloaliphatic carboxylic acid characterized by its branched alkyl structure, which imparts steric hindrance and influences its reactivity and solubility properties. The cyclohexyl group enhances lipophilicity, making it useful in organic synthesis, particularly in the preparation of esters, amides, and other derivatives. Its stability under various conditions and compatibility with common reagents make it a versatile intermediate in pharmaceutical and agrochemical applications. The compound’s defined molecular structure ensures consistent performance in reactions requiring controlled steric and electronic effects. Suitable for use in research and industrial processes, it offers a balance of reactivity and stability for specialized synthetic pathways.
2-cyclohexyl-2-methylpropanoic acid structure
16386-97-3 structure
Product Name:2-cyclohexyl-2-methylpropanoic acid
CAS No:16386-97-3
MF:C10H18O2
MW:170.248723506927
MDL:MFCD19301319
CID:211883
PubChem ID:177742
Update Time:2025-05-20

2-cyclohexyl-2-methylpropanoic acid Chemical and Physical Properties

Names and Identifiers

    • Cyclohexaneacetic acid,a,a-dimethyl-
    • 2-cyclohexyl-2-methylpropanoic acid
    • EN300-99409
    • CS-0265583
    • SCHEMBL1876976
    • AT29340
    • 16386-97-3
    • F8889-4798
    • 2-cyclohexyl-2-methylpropanoicacid
    • Cyclohexaneacetic acid, alpha,alpha-dimethyl-
    • LQTWWEVXGRFIDW-UHFFFAOYSA-N
    • DTXSID60167668
    • AKOS017514723
    • FT-0749532
    • Z1251357448
    • DA-26337
    • MDL: MFCD19301319
    • Inchi: 1S/C10H18O2/c1-10(2,9(11)12)8-6-4-3-5-7-8/h8H,3-7H2,1-2H3,(H,11,12)
    • InChI Key: LQTWWEVXGRFIDW-UHFFFAOYSA-N
    • SMILES: OC(C(C)(C)C1CCCCC1)=O

Computed Properties

  • Exact Mass: 170.13074
  • Monoisotopic Mass: 170.131
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 167
  • 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: 3.4
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Color/Form: No data available
  • Density: 1.0±0.1 g/cm3
  • Melting Point: NA
  • Boiling Point: 278.1±8.0 °C at 760 mmHg
  • Flash Point: 135.0±9.8 °C
  • Refractive Index: 1.478
  • PSA: 37.3
  • Vapor Pressure: 0.0±1.2 mmHg at 25°C

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2-cyclohexyl-2-methylpropanoic acid Suppliers

Amadis Chemical Company Limited
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(CAS:16386-97-3)2-cyclohexyl-2-methylpropanoic acid
Order Number:A1068475
Stock Status:in Stock
Quantity:50mg/100mg/250mg/1g
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 18:40
Price ($):410.0/613.0/872.0/1765.0

2-cyclohexyl-2-methylpropanoic acid Related Literature

Additional information on 2-cyclohexyl-2-methylpropanoic acid

Introduction to 2-cyclohexyl-2-methylpropanoic Acid (CAS No. 16386-97-3)

2-cyclohexyl-2-methylpropanoic acid, with the chemical formula C11H20O2, is a significant compound in the field of organic chemistry and pharmaceutical research. Its unique structural properties make it a valuable intermediate in the synthesis of various bioactive molecules. This compound, identified by its CAS number CAS No. 16386-97-3, has garnered attention due to its potential applications in drug development and industrial processes.

The molecular structure of 2-cyclohexyl-2-methylpropanoic acid consists of a cyclohexyl group attached to a secondary butanoic acid moiety. This configuration imparts a high degree of steric hindrance, which can be exploited in the design of chiral catalysts and asymmetric synthesis pathways. The presence of both cyclohexyl and methyl groups contributes to its versatility, allowing for diverse chemical modifications and functionalizations.

In recent years, there has been growing interest in the applications of 2-cyclohexyl-2-methylpropanoic acid in pharmaceutical research. Its structural motif is reminiscent of several natural products and drug candidates, making it a promising scaffold for further derivatization. For instance, researchers have explored its utility in the synthesis of nonsteroidal anti-inflammatory drugs (NSAIDs) and other therapeutic agents. The cyclohexyl ring, in particular, has been shown to enhance binding affinity to biological targets, a crucial factor in drug design.

One of the most compelling aspects of 2-cyclohexyl-2-methylpropanoic acid is its role as a building block in the construction of complex organic molecules. Its reactivity allows for the introduction of various functional groups, enabling the creation of novel compounds with tailored properties. This flexibility has made it a staple in synthetic organic chemistry laboratories worldwide.

The industrial significance of CAS No. 16386-97-3 cannot be overstated. It serves as a key intermediate in the production of specialty chemicals and fine chemicals, where precise control over molecular structure is essential. The compound's stability under various reaction conditions further enhances its utility, making it suitable for large-scale synthesis.

Recent advancements in green chemistry have also highlighted the importance of 2-cyclohexyl-2-methylpropanoic acid. Researchers are increasingly focusing on developing sustainable synthetic routes that minimize waste and energy consumption. The compound's compatibility with catalytic processes aligns well with these goals, offering a pathway to more environmentally friendly chemical manufacturing.

In addition to its pharmaceutical applications, CAS No. 16386-97-3 has found use in materials science and polymer chemistry. Its ability to act as a monomer or crosslinking agent has led to the development of novel polymers with enhanced mechanical properties. These materials have potential applications in coatings, adhesives, and even biodegradable plastics.

The future prospects for 2-cyclohexyl-2-methylpropanoic acid are bright, driven by ongoing research into its derivatives and new synthetic methodologies. As our understanding of its reactivity and structural features continues to grow, so too will its applications across multiple industries. The compound's unique properties make it a cornerstone of modern organic synthesis, with far-reaching implications for science and technology.

In conclusion, 2-cyclohexyl-2-methylpropanoic acid (CAS No. 16386-97-3) is a multifaceted compound with significant potential in pharmaceuticals, materials science, and industrial chemistry. Its structural versatility and reactivity make it an indispensable tool for researchers and chemists alike. As innovation continues to drive the field forward, this compound will undoubtedly play an even greater role in shaping the future of chemical research and application.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:16386-97-3)2-cyclohexyl-2-methylpropanoic acid
A1068475
Purity:99%/99%/99%/99%
Quantity:50mg/100mg/250mg/1g
Price ($):410.0/613.0/872.0/1765.0
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