Cas no 1644237-21-7 (2-(2-fluoro-4-nitrophenyl)-2-methylpropan-1-ol)

2-(2-Fluoro-4-nitrophenyl)-2-methylpropan-1-ol is a fluorinated nitroaromatic compound with a branched alcohol functional group. Its unique structure, featuring both electron-withdrawing (fluoro and nitro) and sterically hindered (tertiary carbon) substituents, makes it a valuable intermediate in organic synthesis, particularly for pharmaceuticals and agrochemicals. The fluorine atom enhances metabolic stability and binding affinity, while the nitro group offers reactivity for further functionalization. The tertiary alcohol moiety provides a handle for derivatization or chiral resolution. This compound is particularly useful in the development of bioactive molecules due to its balanced lipophilicity and polarity, facilitating optimized pharmacokinetic properties. Its synthetic versatility makes it suitable for constructing complex scaffolds in medicinal chemistry.
2-(2-fluoro-4-nitrophenyl)-2-methylpropan-1-ol structure
1644237-21-7 structure
Product Name:2-(2-fluoro-4-nitrophenyl)-2-methylpropan-1-ol
CAS No:1644237-21-7
MF:C10H12FNO3
MW:213.205586433411
CID:5796033
PubChem ID:121316301
Update Time:2025-10-23

2-(2-fluoro-4-nitrophenyl)-2-methylpropan-1-ol Chemical and Physical Properties

Names and Identifiers

    • 2-(2-fluoro-4-nitrophenyl)-2-methylpropan-1-ol
    • EN300-1757663
    • 1644237-21-7
    • SCHEMBL17726403
    • Inchi： 1S/C10H12FNO3/c1-10(2,6-13)8-4-3-7(12(14)15)5-9(8)11/h3-5,13H,6H2,1-2H3
    • InChI Key： GNGVLXQTZXMRJK-UHFFFAOYSA-N
    • SMILES： FC1C=C(C=CC=1C(C)(C)CO)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 213.08012141g/mol
  • Monoisotopic Mass: 213.08012141g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 239
  • 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: 2.3
  • Topological Polar Surface Area: 66?2

2-(2-fluoro-4-nitrophenyl)-2-methylpropan-1-ol Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-1757663-0.05g
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 $924.0 2023-09-20
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2-(2-fluoro-4-nitrophenyl)-2-methylpropan-1-ol Related Literature

Additional information on 2-(2-fluoro-4-nitrophenyl)-2-methylpropan-1-ol

Comprehensive Overview of 2-(2-Fluoro-4-nitrophenyl)-2-methylpropan-1-ol (CAS No. 1644237-21-7): Properties, Applications, and Industry Insights

In the rapidly evolving field of specialty chemicals, 2-(2-fluoro-4-nitrophenyl)-2-methylpropan-1-ol (CAS No. 1644237-21-7) has garnered significant attention due to its unique structural features and versatile applications. This compound, characterized by a fluorinated aromatic ring and a nitro group, serves as a critical intermediate in pharmaceutical synthesis, agrochemical development, and material science. Researchers and industry professionals frequently search for terms like "fluoro-nitro aromatic compounds", "high-purity chemical intermediates", and "CAS 1644237-21-7 supplier", reflecting its growing demand.

The molecular structure of 2-(2-fluoro-4-nitrophenyl)-2-methylpropan-1-ol combines a bulky tert-butyl alcohol moiety with electron-withdrawing substituents, making it valuable for catalysis studies and drug design. Recent trends in green chemistry have spurred interest in optimizing its synthesis to reduce waste, aligning with searches for "sustainable nitroaromatic production" and "eco-friendly fluorination methods". Its lipophilicity and hydrogen-bonding capacity also make it a candidate for bioconjugation in biopharmaceuticals.

Analytical techniques such as HPLC, NMR, and mass spectrometry are essential for verifying the purity of CAS No. 1644237-21-7, a top concern for buyers searching "analytical standards for fluorinated intermediates". The compound’s stability under ambient storage conditions (recommended: 2–8°C in inert atmosphere) further enhances its practicality for industrial use. Innovations in flow chemistry and continuous manufacturing have been explored to scale up production efficiently.

Beyond pharmaceuticals, 2-(2-fluoro-4-nitrophenyl)-2-methylpropan-1-ol finds niche applications in advanced material research, particularly in photoactive polymers and liquid crystal formulations. Queries like "nitroaromatics in OLED materials" highlight this intersection. Regulatory compliance (e.g., REACH, FDA guidelines) remains a key discussion point, with suppliers emphasizing GMP-grade synthesis to meet quality benchmarks.

Future prospects for this compound include potential roles in PET radiopharmaceuticals (due to its fluorine content) and covalent organic frameworks (COFs). As the industry shifts toward precision chemistry, demand for well-characterized intermediates like CAS No. 1644237-21-7 will continue to rise, driven by searches for "custom fluorination services" and "nitrophenol derivatives catalog".

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