Cas no 2649023-37-8 (1-(2-Isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane)

1-(2-Isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane is a cycloaliphatic isocyanate compound characterized by its sterically hindered structure, which contributes to enhanced stability and controlled reactivity. The presence of both isocyanate and isopropyl functional groups on the cyclohexane ring imparts unique properties, making it suitable for specialized polyurethane applications. Its structural configuration allows for tailored crosslinking in polymer systems, improving mechanical and thermal resistance in cured materials. The compound is particularly valuable in high-performance coatings, adhesives, and elastomers where durability and chemical resistance are critical. Its low volatility and compatibility with various polyols further enhance its utility in formulating advanced polyurethane materials.
1-(2-Isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane structure
2649023-37-8 structure
Product Name:1-(2-Isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane
CAS No:2649023-37-8
MF:C13H23NO
MW:209.327823877335
CID:5778919
PubChem ID:165641389
Update Time:2025-05-23

1-(2-Isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane Chemical and Physical Properties

Names and Identifiers

    • 1-(2-isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane
    • EN300-1747568
    • 2649023-37-8
    • 1-(2-Isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane
    • Inchi: 1S/C13H23NO/c1-10(2)11-5-7-12(8-6-11)13(3,4)14-9-15/h10-12H,5-8H2,1-4H3
    • InChI Key: MUWUQMCXINIXIT-UHFFFAOYSA-N
    • SMILES: O=C=NC(C)(C)C1CCC(C(C)C)CC1

Computed Properties

  • Exact Mass: 209.177964357g/mol
  • Monoisotopic Mass: 209.177964357g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 243
  • 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: 5
  • Topological Polar Surface Area: 29.4?2

1-(2-Isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane Pricemore >>

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Additional information on 1-(2-Isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane

1-(2-Isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane: A Comprehensive Overview

1-(2-Isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane, also known by its CAS number 2649023-37-8, is a versatile organic compound with significant applications in various industries. This compound is a derivative of cyclohexane, a six-membered ring hydrocarbon, with two substituents: an isocyanate group and an isopropyl group. The isocyanate group (-NCO) is attached to the cyclohexane ring at the 1-position, while the isopropyl group (-CH(CH?)?) is attached at the 4-position.

The structure of this compound plays a crucial role in its chemical reactivity and physical properties. The cyclohexane ring provides a rigid framework, while the isocyanate group introduces reactivity, making it suitable for various polymerization reactions. The isopropyl group enhances the compound's solubility in organic solvents and improves its compatibility with other materials.

Recent studies have highlighted the potential of 1-(2-isocyanatopropan-2-yl)-4-(propan-2-yl)cyclohexane in the development of advanced materials. For instance, researchers have explored its use in synthesizing polyurethanes with enhanced mechanical properties. The compound's ability to undergo step-growth polymerization with diols or diamines has been extensively studied, leading to the creation of high-performance polymers suitable for automotive and aerospace applications.

In addition to its role in polymer chemistry, this compound has shown promise in biotechnology applications. Scientists have investigated its potential as a precursor for bio-based materials, leveraging its ability to form stable bonds with natural polymers such as proteins and polysaccharides. This opens up new avenues for sustainable material development.

The synthesis of 1-(2-isocyanatopropan-2-yl)-4-(propan-2-y)cyclohexane involves a multi-step process that typically begins with the preparation of the cyclohexane derivative followed by functionalization with the isocyanate group. Recent advancements in catalytic methods have improved the efficiency and selectivity of this synthesis, reducing production costs and minimizing environmental impact.

From an environmental perspective, researchers have focused on developing greener synthesis pathways for this compound. The use of renewable feedstocks and catalytic systems has been explored to reduce reliance on fossil fuels and lower carbon emissions associated with its production.

In conclusion, 1-(2-isocyanatopropan-2-y)cyclohexane (CAS 2649023–37–8) is a valuable compound with diverse applications across multiple industries. Its unique structure and reactivity make it an essential building block for advanced materials, while ongoing research continues to uncover new opportunities for its use in sustainable technologies.

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