Cas no 1368385-65-2 (7-Bromo-5-nitroisoquinoline)

7-Bromo-5-nitroisoquinoline is a heterocyclic aromatic compound featuring a bromo substituent at the 7-position and a nitro group at the 5-position of the isoquinoline scaffold. This compound serves as a versatile intermediate in organic synthesis, particularly in the development of pharmaceuticals, agrochemicals, and functional materials. Its reactive bromo and nitro groups enable selective functionalization, facilitating further derivatization through cross-coupling, nucleophilic substitution, or reduction reactions. The electron-withdrawing nitro group enhances the reactivity of the bromo substituent, making it valuable for constructing complex molecular architectures. High purity and well-defined reactivity make this compound suitable for research and industrial applications requiring precise synthetic control.
7-Bromo-5-nitroisoquinoline structure
7-Bromo-5-nitroisoquinoline structure
Product Name:7-Bromo-5-nitroisoquinoline
CAS No:1368385-65-2
MF:C9H5BrN2O2
MW:253.052201032639
CID:1082864
PubChem ID:72942369
Update Time:2025-11-01

7-Bromo-5-nitroisoquinoline Chemical and Physical Properties

Names and Identifiers

    • 7-Bromo-5-nitroisoquinoline
    • 1368385-65-2
    • DA-19366
    • Inchi: 1S/C9H5BrN2O2/c10-7-3-6-5-11-2-1-8(6)9(4-7)12(13)14/h1-5H
    • InChI Key: AFCAXUDCBMAYMO-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C2C=CN=CC=2C=1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 251.95344g/mol
  • Monoisotopic Mass: 251.95344g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 231
  • 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: 2.6
  • Topological Polar Surface Area: 58.7?2

7-Bromo-5-nitroisoquinoline Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Chemenu
CM258031-1g
7-Bromo-5-nitroisoquinoline
1368385-65-2 95%
1g
$486 2021-08-18
Chemenu
CM258031-1g
7-Bromo-5-nitroisoquinoline
1368385-65-2 95%
1g
$*** 2023-03-30

7-Bromo-5-nitroisoquinoline Related Literature

Additional information on 7-Bromo-5-nitroisoquinoline

7-Bromo-5-nitroisoquinoline (CAS No. 1368385-65-2): A Comprehensive Overview of Its Properties and Applications

7-Bromo-5-nitroisoquinoline (CAS No. 1368385-65-2) is a highly specialized organic compound that has garnered significant attention in the fields of medicinal chemistry, material science, and agrochemical research. This heterocyclic compound, characterized by its bromo and nitro functional groups, serves as a versatile building block for synthesizing more complex molecules. Its unique structural features make it a valuable intermediate in the development of pharmaceuticals, fluorescent dyes, and advanced materials.

The growing interest in 7-Bromo-5-nitroisoquinoline is reflected in the increasing number of searches related to its synthesis methods, applications in drug discovery, and role in organic electronics. Researchers and industry professionals are particularly keen on understanding how this compound can be leveraged to address contemporary challenges, such as the development of novel antimicrobial agents or the design of next-generation organic light-emitting diodes (OLEDs).

One of the most frequently asked questions about 7-Bromo-5-nitroisoquinoline revolves around its solubility and reactivity. Studies indicate that this compound exhibits moderate solubility in polar organic solvents like dimethyl sulfoxide (DMSO) and acetonitrile, which facilitates its use in various chemical reactions. Its reactivity is primarily influenced by the electron-withdrawing effects of the nitro group, making it a suitable candidate for nucleophilic aromatic substitution reactions.

In the context of medicinal chemistry, 7-Bromo-5-nitroisoquinoline has been explored as a precursor for the synthesis of biologically active molecules. For instance, its derivatives have shown promise in targeting specific enzymes involved in inflammatory pathways. This aligns with the current trend of developing small-molecule inhibitors for therapeutic applications, a topic that has seen a surge in online searches and academic publications.

Another area where 7-Bromo-5-nitroisoquinoline is making waves is in the field of organic electronics. With the rise of sustainable technologies, researchers are investigating how this compound can be incorporated into organic semiconductors or photovoltaic materials. Its ability to undergo facile functionalization makes it an attractive candidate for tailoring electronic properties, a subject that resonates with the growing demand for green chemistry solutions.

From a synthetic chemistry perspective, the compound's bromo substituent offers a convenient handle for further derivatization via cross-coupling reactions, such as Suzuki or Buchwald-Hartwig couplings. This flexibility has led to its widespread use in constructing complex molecular architectures, a topic frequently discussed in online forums and research communities.

In summary, 7-Bromo-5-nitroisoquinoline (CAS No. 1368385-65-2) is a multifaceted compound with broad applicability across multiple scientific disciplines. Its relevance to current research trends, coupled with its synthetic versatility, ensures that it will remain a focal point of innovation in the years to come. Whether you're a chemist exploring new reaction pathways or a material scientist designing advanced functional materials, this compound offers a wealth of opportunities for discovery and application.

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