Cas no 1991-43-1 (Benzenamine, 2,3,5,6-tetrafluoro-4-iodo-)

Benzenamine, 2,3,5,6-tetrafluoro-4-iodo- structure
1991-43-1 structure
Product Name:Benzenamine, 2,3,5,6-tetrafluoro-4-iodo-
CAS No:1991-43-1
MF:C6H2F4IN
MW:290.984867572784
CID:1390713
PubChem ID:13355333
Update Time:2025-07-22

Benzenamine, 2,3,5,6-tetrafluoro-4-iodo- Chemical and Physical Properties

Names and Identifiers

    • Benzenamine, 2,3,5,6-tetrafluoro-4-iodo-
    • G65036
    • EN300-115882
    • Z1493030393
    • 1991-43-1
    • 4-Iodo-2,3,5,6-tetrafluoroaniline
    • BAA99143
    • 2,3,5,6-TETRAFLUORO-4-IODOANILINE
    • MFCD22055364
    • Inchi: 1S/C6H2F4IN/c7-1-3(9)6(12)4(10)2(8)5(1)11/h12H2
    • InChI Key: HZVULQPRWQVUGO-UHFFFAOYSA-N
    • SMILES: IC1=C(C(=C(C(=C1F)F)N)F)F

Computed Properties

  • Exact Mass: 290.91636
  • Monoisotopic Mass: 290.91681g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 154
  • 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: 26?2

Experimental Properties

  • PSA: 26.02

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abcr
AB600414-250mg
2,3,5,6-Tetrafluoro-4-iodoaniline; .
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250mg
€168.30 2025-04-20
abcr
AB600414-1g
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€342.70 2025-04-20

Additional information on Benzenamine, 2,3,5,6-tetrafluoro-4-iodo-

Benzenamine, 2,3,5,6-tetrafluoro-4-iodo- (CAS No. 1991-43-1): A Comprehensive Overview

Benzenamine, 2,3,5,6-tetrafluoro-4-iodo-, identified by the CAS number 1991-43-1, is a fluorinated and iodinated aromatic amine with significant potential in pharmaceutical and materials science research. This compound has garnered attention due to its unique structural features and its utility as a building block in the synthesis of more complex molecules.

The molecular structure of Benzenamine, 2,3,5,6-tetrafluoro-4-iodo- consists of a benzene ring substituted with four fluorine atoms and one iodine atom at the 4-position. This arrangement imparts distinct electronic and steric properties to the molecule, making it a valuable intermediate in organic synthesis. The presence of both fluorine and iodine atoms allows for further functionalization through various chemical reactions, including cross-coupling reactions, nucleophilic substitutions, and metal-catalyzed transformations.

In recent years, there has been growing interest in the development of novel pharmaceutical agents that incorporate fluorinated and halogenated aromatic systems. These structural motifs are known to enhance metabolic stability, improve bioavailability, and modulate binding interactions with biological targets. The compound Benzenamine, 2,3,5,6-tetrafluoro-4-iodo- fits well within this framework and has been explored in several research studies as a precursor for drug candidates.

One notable application of Benzenamine, 2,3,5,6-tetrafluoro-4-iodo- is in the synthesis of kinase inhibitors. Kinases are enzymes that play crucial roles in cell signaling pathways and are often targeted in the development of anti-cancer therapies. By incorporating fluorinated and iodinated aromatic groups into kinase inhibitors, researchers can achieve improved selectivity and potency. For instance, studies have demonstrated that compounds derived from Benzenamine, 2,3,5,6-tetrafluoro-4-iodo- exhibit promising activity against various kinases by modulating their binding affinities.

The role of fluorine atoms in pharmaceuticals is well-documented due to their ability to influence pharmacokinetic properties such as lipophilicity and metabolic stability. The presence of multiple fluorine atoms in Benzenamine, 2,3,5,6-tetrafluoro-4-iodo- enhances these effects, making it an attractive scaffold for drug design. Additionally, the iodine atom provides a handle for further chemical manipulation through transition metal-catalyzed reactions like Suzuki-Miyaura cross-coupling and Stille coupling.

In materials science, Benzenamine, 2,3,5,6-tetrafluoro-4-iodo- has been investigated for its potential applications in organic electronics. Fluorinated aromatic compounds are widely used in the development of organic light-emitting diodes (OLEDs), organic photovoltaics (OPVs), and other advanced materials due to their tunable electronic properties and high thermal stability. The unique combination of fluorine and iodine substituents in this compound makes it a promising candidate for designing novel materials with enhanced performance characteristics.

The synthesis of Benzenamine, 2,3,5,6-tetrafluoro-4-iodo- involves multi-step organic transformations that require careful optimization to achieve high yields and purity. Common synthetic routes include halogenation reactions followed by selective functionalization at specific positions on the benzene ring. Advanced techniques such as palladium-catalyzed cross-coupling reactions have been employed to introduce the desired substituents with high precision.

The reactivity of Benzenamine, 2,3,5,6-tetrafluoro-4-iodo- makes it a versatile intermediate for constructing complex molecular architectures. Researchers have leveraged its structural features to develop novel heterocyclic compounds with potential biological activity. For example, derivatives of this compound have been shown to exhibit inhibitory effects on enzymes involved in infectious diseases, highlighting its therapeutic potential.

The growing body of research on Benzenamine??? 2,3,5,6-tetrafluoro-4-Iodo- highlights its importance as a multifunctional building block in both pharmaceuticals and materials science。 Its unique structural features, combined with its reactivity, make it a valuable asset for synthetic chemists working on next-generation drug candidates and advanced materials。

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