Cas no 2229343-89-7 (2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol)

2,2,2-Trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol is a fluorinated indole derivative with potential applications in pharmaceutical and agrochemical research. The presence of a trifluoromethyl group enhances its metabolic stability and lipophilicity, making it a valuable intermediate for drug discovery. The indole scaffold is known for its bioactivity, and the 1-methyl substitution may influence binding affinity in target interactions. This compound’s structural features, including the hydroxyl group, allow for further functionalization, enabling the synthesis of more complex molecules. Its well-defined purity and stability under standard conditions make it suitable for use in exploratory synthetic chemistry and mechanistic studies.
2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol structure
2229343-89-7 structure
Product Name:2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol
CAS No:2229343-89-7
MF:C11H10F3NO
MW:229.19841337204
CID:5778229
PubChem ID:165673398
Update Time:2025-11-02

2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol Chemical and Physical Properties

Names and Identifiers

    • 2229343-89-7
    • EN300-1943498
    • 2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol
    • Inchi: 1S/C11H10F3NO/c1-15-5-4-7-2-3-8(6-9(7)15)10(16)11(12,13)14/h2-6,10,16H,1H3
    • InChI Key: YOKMKVNQZXUVBA-UHFFFAOYSA-N
    • SMILES: FC(C(C1C=CC2C=CN(C)C=2C=1)O)(F)F

Computed Properties

  • Exact Mass: 229.07144843g/mol
  • Monoisotopic Mass: 229.07144843g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 1
  • Complexity: 256
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.3
  • Topological Polar Surface Area: 25.2?2

2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol Pricemore >>

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Additional information on 2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol

Comprehensive Guide to 2,2,2-Trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol (CAS No. 2229343-89-7): Properties, Applications, and Market Insights

2,2,2-Trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol (CAS No. 2229343-89-7) is a fluorinated indole derivative gaining attention in pharmaceutical and agrochemical research. This compound, characterized by its trifluoromethyl group and indole backbone, exhibits unique physicochemical properties that make it valuable for drug discovery and material science applications.

The molecular structure of 2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol combines the electron-withdrawing properties of fluorine atoms with the versatile indole scaffold, creating a compound with interesting hydrogen-bonding capabilities. Researchers are particularly interested in its potential as a building block for bioactive molecules, given the increasing demand for fluorinated compounds in modern medicinal chemistry.

Recent studies highlight the compound's relevance in developing novel kinase inhibitors, a hot topic in cancer research. The trifluoroethanol moiety contributes to enhanced binding affinity and metabolic stability, addressing key challenges in drug development. Pharmaceutical companies are exploring derivatives of CAS 2229343-89-7 for targeted therapies, especially in oncology and neurological disorders.

In material science, 2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol serves as a precursor for advanced fluorinated polymers with improved thermal stability and chemical resistance. The growing demand for high-performance materials in electronics and aerospace industries has increased interest in such fluorinated intermediates.

The synthesis of 2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol typically involves multi-step organic reactions, with researchers continuously optimizing routes for better yields and sustainability. Green chemistry approaches using catalytic fluorination methods are becoming particularly relevant, aligning with current industry trends toward environmentally friendly processes.

Analytical characterization of CAS 2229343-89-7 employs advanced techniques including NMR spectroscopy, mass spectrometry, and X-ray crystallography. These methods confirm the compound's purity and structural features, essential for research applications. The compound typically appears as a white to off-white crystalline solid with specific melting point characteristics.

Market analysis indicates growing demand for fluorinated indole derivatives, with 2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol positioned as a valuable intermediate. Pharmaceutical and agrochemical sectors drive this demand, particularly in regions with strong R&D infrastructure like North America, Europe, and parts of Asia.

Storage and handling of 2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol require standard laboratory precautions. While not classified as highly hazardous, proper ventilation and personal protective equipment are recommended when working with this compound, as with all fine chemicals.

Future research directions for CAS 2229343-89-7 include exploring its potential in PET radiopharmaceuticals (given the fluorine content) and as a scaffold for proteolysis targeting chimeras (PROTACs), both cutting-edge areas in drug discovery. The compound's versatility suggests it will remain relevant as new applications emerge in chemical biology and materials science.

For researchers sourcing 2,2,2-trifluoro-1-(1-methyl-1H-indol-6-yl)ethan-1-ol, quality specifications including purity levels (typically ≥95% by HPLC) and batch-to-batch consistency are critical factors. Reputable suppliers provide comprehensive analytical data and proper documentation to support research applications.

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