Cas no 885529-55-5 (1-(Bromomethyl)-4-difluoromethanesulfonylbenzene)

1-(Bromomethyl)-4-difluoromethanesulfonylbenzene is a versatile aryl bromide derivative featuring both a bromomethyl group and a difluoromethanesulfonyl substituent on the benzene ring. This compound is particularly valuable in synthetic organic chemistry as a bifunctional building block, enabling selective modifications at either the benzylic bromine or the sulfonyl group. The difluoromethanesulfonyl moiety enhances electrophilic reactivity, while the bromomethyl group facilitates nucleophilic substitution or cross-coupling reactions. Its stability under a range of conditions makes it suitable for applications in pharmaceuticals, agrochemicals, and materials science. The presence of fluorine atoms further contributes to its utility in designing bioactive molecules with improved metabolic stability and binding affinity.
1-(Bromomethyl)-4-difluoromethanesulfonylbenzene structure
885529-55-5 structure
Product Name:1-(Bromomethyl)-4-difluoromethanesulfonylbenzene
CAS No:885529-55-5
MF:C8H7BrF2O2S
MW:285.10578751564
MDL:MFCD08444195
CID:1082119
PubChem ID:16227062
Update Time:2025-10-30

1-(Bromomethyl)-4-difluoromethanesulfonylbenzene Chemical and Physical Properties

Names and Identifiers

    • 1-(Bromomethyl)-4-[(difluoromethyl)sulfonyl]benzene
    • 1-(bromomethyl)-4-(difluoromethylsulfonyl)benzene
    • 1-(Bromomethyl)-4-((difluoromethyl)sulfonyl)benzene
    • FT-0695967
    • OVBMBMKLODKZGR-UHFFFAOYSA-N
    • 4-(difluoromethyl-sulfonyl)benzyl bromide
    • EN300-23825
    • 1-(bromomethyl)-4-(difluoromethane)sulfonylbenzene
    • SCHEMBL18581452
    • 1-(bromomethyl)-4-difluoromethanesulfonylbenzene
    • 885529-55-5
    • DB-005599
    • 1-(Bromomethyl)-4-difluoromethanesulfonylbenzene
    • MDL: MFCD08444195
    • Inchi: 1S/C8H7BrF2O2S/c9-5-6-1-3-7(4-2-6)14(12,13)8(10)11/h1-4,8H,5H2
    • InChI Key: OVBMBMKLODKZGR-UHFFFAOYSA-N
    • SMILES: BrCC1C=CC(=CC=1)S(C(F)F)(=O)=O

Computed Properties

  • Exact Mass: 283.93182g/mol
  • Monoisotopic Mass: 283.93182g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 266
  • 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: 2.7
  • Topological Polar Surface Area: 42.5?2

1-(Bromomethyl)-4-difluoromethanesulfonylbenzene Pricemore >>

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1-(Bromomethyl)-4-difluoromethanesulfonylbenzene Related Literature

Additional information on 1-(Bromomethyl)-4-difluoromethanesulfonylbenzene

1-(Bromomethyl)-4-difluoromethanesulfonylbenzene: A Comprehensive Overview

1-(Bromomethyl)-4-difluoromethanesulfonylbenzene, also known by its CAS number 885529-55-5, is a highly specialized organic compound with significant applications in various fields of chemistry and materials science. This compound is characterized by its unique structure, which combines a bromomethyl group and a difluoromethanesulfonyl group attached to a benzene ring. The combination of these functional groups imparts distinctive chemical properties, making it a valuable compound in both academic research and industrial applications.

The synthesis of 1-(Bromomethyl)-4-difluoromethanesulfonylbenzene involves a series of precise chemical reactions, including nucleophilic substitution and electrophilic aromatic substitution. These reactions are carefully controlled to ensure the formation of the desired product with high purity and yield. The compound's structure has been extensively studied using advanced spectroscopic techniques such as NMR, IR, and mass spectrometry, which have provided detailed insights into its molecular geometry and electronic properties.

Recent studies have highlighted the potential of 1-(Bromomethyl)-4-difluoromethanesulfonylbenzene in the field of drug discovery. Its unique electronic properties make it an ideal candidate for use as a building block in the synthesis of bioactive molecules. For instance, researchers have explored its role in the development of new antiviral agents, where its ability to interact with specific viral proteins has shown promising results. Additionally, the compound has been utilized in the design of novel materials with enhanced thermal stability and mechanical properties.

In terms of environmental applications, 1-(Bromomethyl)-4-difluoromethanesulfonylbenzene has been investigated for its potential in pollution control technologies. Its ability to act as a catalyst in certain chemical reactions has led to its use in the degradation of organic pollutants in water systems. This application is particularly relevant given the increasing global focus on sustainable chemistry and green technologies.

The latest research on CAS No 885529-55-5 has also delved into its photochemical properties. Studies have shown that the compound exhibits interesting fluorescence behavior under UV light, which could be harnessed for applications in optoelectronics and sensors. Furthermore, its reactivity towards various nucleophiles and electrophiles has been explored, providing valuable insights into its potential as a versatile reagent in organic synthesis.

In conclusion, 1-(Bromomethyl)-4-difluoromethanesulfonylbenzene, with its CAS number 885529-55-5, is a compound of great scientific interest due to its diverse applications and unique chemical properties. Ongoing research continues to uncover new avenues for its use, ensuring that it remains at the forefront of chemical innovation.

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