Cas no 61491-92-7 (2-Isobutyl-1H-imidazole)

2-Isobutyl-1H-imidazole is a heterocyclic organic compound featuring an imidazole core substituted with an isobutyl group at the 2-position. This structure imparts unique chemical properties, making it a valuable intermediate in pharmaceutical and agrochemical synthesis. Its imidazole ring contributes to strong coordination and hydrogen-bonding capabilities, while the isobutyl moiety enhances lipophilicity, improving solubility in organic matrices. The compound is particularly useful in catalysis, ligand design, and as a building block for bioactive molecules. Its stability under a range of conditions and compatibility with diverse reaction pathways further underscore its utility in fine chemical and industrial applications. Proper handling and storage are recommended due to its reactive functional groups.
2-Isobutyl-1H-imidazole structure
2-Isobutyl-1H-imidazole structure
Product Name:2-Isobutyl-1H-imidazole
CAS No:61491-92-7
MF:C7H12N2
MW:124.183581352234
MDL:MFCD15146457
CID:954596
PubChem ID:109093
Update Time:2025-10-30

2-Isobutyl-1H-imidazole Chemical and Physical Properties

Names and Identifiers

    • 2-Isobutyl-1H-imidazole
    • 2-(2-Methylpropyl)-1H-imidazole
    • 2-isobutyl-1H-imidazole(SALTDATA: FREE)
    • AZ4ERD9CXD
    • DTXSID30210458
    • 1H-Imidazole, 2-(2-methylpropyl)-
    • NS00034703
    • CS-0315760
    • AKOS005174155
    • CHEMBL3810086
    • MFCD15146457
    • SCHEMBL233107
    • LS-04235
    • RFXJLECGYGFJCI-UHFFFAOYSA-N
    • 2-isobutylimidazole
    • 61491-92-7
    • EINECS 262-818-6
    • DTXCID30132949
    • ALBB-013590
    • MDL: MFCD15146457
    • Inchi: 1S/C7H12N2/c1-6(2)5-7-8-3-4-9-7/h3-4,6H,5H2,1-2H3,(H,8,9)
    • InChI Key: RFXJLECGYGFJCI-UHFFFAOYSA-N
    • SMILES: N1C=CN=C1CC(C)C

Computed Properties

  • Exact Mass: 124.10016
  • Monoisotopic Mass: 124.100048391g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 2
  • Complexity: 81
  • 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: 1.7
  • Topological Polar Surface Area: 28.7?2

Experimental Properties

  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 269.9±9.0 °C at 760 mmHg
  • Flash Point: 124.9±5.1 °C
  • PSA: 28.68
  • Vapor Pressure: 0.0±0.5 mmHg at 25°C

2-Isobutyl-1H-imidazole Security Information

2-Isobutyl-1H-imidazole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI XIAN DING Biotechnology Co., Ltd.
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$ 70.00 2022-06-07
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abcr
AB294208-250 mg
2-Isobutyl-1H-imidazole; 95%
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abcr
AB294208-1 g
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abcr
AB294208-5 g
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€749.60 2023-07-20
SHANG HAI XIAN DING Biotechnology Co., Ltd.
063492-500mg
2-Isobutyl-1H-imidazole
61491-92-7
500mg
6404.0CNY 2021-07-10
Chemenu
CM275763-1g
2-Isobutyl-1H-imidazole
61491-92-7 95%
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$*** 2023-05-30

2-Isobutyl-1H-imidazole Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:61491-92-7)2-Isobutyl-1H-imidazole
Order Number:A1168131
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 01:10
Price ($):1341.0

Additional information on 2-Isobutyl-1H-imidazole

2-Isobutyl-1H-imidazole: A Comprehensive Overview

2-Isobutyl-1H-imidazole (CAS No. 61491-92-7) is a heterocyclic organic compound that has garnered significant attention in the fields of organic chemistry, materials science, and pharmacology. This compound belongs to the imidazole family, which is a five-membered ring consisting of two nitrogen atoms and three carbon atoms. The isobutyl substituent attached to the imidazole ring imparts unique chemical and physical properties, making it a versatile molecule with potential applications in various industries.

The synthesis of 2-isobutyl-1H-imidazole involves a combination of nucleophilic aromatic substitution and condensation reactions. Recent advancements in catalytic methods have enabled the efficient production of this compound with high purity. Researchers have explored the use of transition metal catalysts, such as palladium and copper complexes, to optimize the reaction conditions. These studies have not only improved the yield but also reduced the environmental footprint of the synthesis process.

One of the most promising applications of 2-isobutyl-1H-imidazole lies in its use as a building block for constructing advanced materials. For instance, this compound can be incorporated into polymer networks to enhance their thermal stability and mechanical strength. Recent studies have demonstrated that imidazole derivatives, including 2-isobutyl-1H-imidazole, can serve as cross-linking agents in epoxy resins, leading to materials with improved adhesion properties. This makes them ideal for aerospace and automotive industries where high-performance materials are critical.

In the field of pharmacology, 2-isobutyl-1H-imidazole has shown potential as a lead compound for drug discovery. Its ability to form hydrogen bonds and its rigid structure make it an attractive candidate for designing bioactive molecules. Researchers have investigated its role as a template for creating inhibitors against enzymes such as kinases and proteases. Preliminary results indicate that imidazole-based compounds could exhibit selective binding to target proteins, paving the way for novel therapeutic agents.

The electronic properties of 2-isobutyl-1H-imidazole also make it a valuable component in optoelectronic devices. Its conjugated system allows for efficient charge transport, which is essential for applications in organic light-emitting diodes (OLEDs) and photovoltaic cells. Recent breakthroughs in molecular design have focused on modifying the substituents on the imidazole ring to enhance its optical properties. For example, introducing electron-withdrawing groups has been shown to increase the fluorescence quantum yield, making it suitable for sensing applications.

From an environmental perspective, 2-isobutyl-1H-imidazole exhibits low toxicity and biodegradability under certain conditions. This makes it a safer alternative to traditional chemicals used in industrial processes. However, further research is needed to fully understand its long-term impact on ecosystems and human health.

In conclusion, 2-isobutyl-1H-imidazole (CAS No. 61491-92-7) is a multifaceted compound with diverse applications across various disciplines. Its unique chemical structure, combined with recent advancements in synthesis and application development, positions it as a key player in modern material science and pharmacology. As research continues to uncover new functionalities and optimizations, this compound is poised to make significant contributions to both academic and industrial sectors.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:61491-92-7)2-Isobutyl-1H-imidazole
A1168131
Purity:99%
Quantity:5g
Price ($):1341.0
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