Cas no 84478-69-3 (BENZENAMINE, 4-BROMO-2-FLUORO-5-PROPOXY-)

4-Bromo-2-fluoro-5-propoxybenzenamine is a halogenated aniline derivative featuring bromo, fluoro, and propoxy substituents on the aromatic ring. This compound is primarily utilized as an intermediate in organic synthesis, particularly in the development of pharmaceuticals, agrochemicals, and specialty chemicals. The presence of electron-withdrawing halogens (bromo and fluoro) enhances its reactivity in electrophilic substitution and cross-coupling reactions, while the propoxy group contributes to solubility and steric modulation. Its well-defined structure and functional group compatibility make it valuable for constructing complex molecules. The compound is typically handled under controlled conditions due to its potential sensitivity to light and moisture. Proper storage and handling protocols are recommended to maintain stability.
BENZENAMINE, 4-BROMO-2-FLUORO-5-PROPOXY- structure
84478-69-3 structure
Product Name:BENZENAMINE, 4-BROMO-2-FLUORO-5-PROPOXY-
CAS No:84478-69-3
MF:C9H11BrFNO
MW:248.092145204544
MDL:MFCD32200945
CID:3359371
PubChem ID:13281431
Update Time:2025-05-27

BENZENAMINE, 4-BROMO-2-FLUORO-5-PROPOXY- Chemical and Physical Properties

Names and Identifiers

    • BENZENAMINE, 4-BROMO-2-FLUORO-5-PROPOXY-
    • 4-Bromo-2-fluoro-5-propoxyaniline
    • MFCD32200945
    • AKOS022663631
    • CID 13281431
    • 84478-69-3
    • D81129
    • BS-17570
    • CS-0163338
    • C9H11BrFNO
    • MDL: MFCD32200945
    • Inchi: 1S/C9H11BrFNO/c1-2-3-13-9-5-8(12)7(11)4-6(9)10/h4-5H,2-3,12H2,1H3
    • InChI Key: HRPOAZFNWXINHZ-UHFFFAOYSA-N
    • SMILES: BrC1=CC(=C(C=C1OCCC)N)F

Computed Properties

  • Exact Mass: 247.00080g/mol
  • Monoisotopic Mass: 247.00080g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 159
  • 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: 2.9
  • Topological Polar Surface Area: 35.2?2

BENZENAMINE, 4-BROMO-2-FLUORO-5-PROPOXY- Pricemore >>

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Additional information on BENZENAMINE, 4-BROMO-2-FLUORO-5-PROPOXY-

BENZENAMINE, 4-BROMO-2-FLUORO-5-PROPOXY (CAS No: 84478-69-3)

BENZENAMINE, 4-BROMO-2-FLUORO-5-PROPOXY is a highly specialized aromatic amine compound with the CAS registry number 84478-69-3. This compound has garnered significant attention in the fields of organic synthesis, materials science, and pharmacology due to its unique structural properties and potential applications. The molecule consists of a benzene ring substituted with three distinct groups: a bromine atom at the 4-position, a fluorine atom at the 2-position, and a propoxy group (-OCH?CH?CH?) at the 5-position. These substituents impart distinctive electronic and steric effects, making it a valuable building block in various chemical reactions.

Recent advancements in synthetic chemistry have enabled the efficient synthesis of BENZENAMINE, 4-BROMO-2-FLUORO-5-PROPOXY through multi-component reactions and catalytic processes. Researchers have explored its use as an intermediate in the construction of bioactive molecules, particularly in drug discovery programs targeting complex diseases such as cancer and neurodegenerative disorders. The presence of halogen atoms (bromine and fluorine) enhances its reactivity in nucleophilic aromatic substitution reactions, making it a versatile precursor for functionalizing aromatic systems.

The structural uniqueness of BENZENAMINE, 4-BROMO-2-FLUORO-5-PROPOXY also renders it useful in materials science applications. For instance, its ability to form stable coordination complexes with transition metals has been exploited in the development of novel catalysts for industrial processes. Additionally, its electronic properties make it a candidate for use in organic electronics, where it could serve as a component in light-emitting diodes (LEDs) or sensors.

From an analytical perspective, BENZENAMINE, 4-BROMO-2-FLOORO-OXOPROPOXY has been employed as a reference standard in chromatographic techniques due to its well-defined physical and chemical properties. Its high purity and stability make it an ideal candidate for calibrating instruments used in quality control processes across various industries.

In terms of safety and handling, BENZENAMINE, 4-BROMO-OXOPROPOXY-FLOOR should be stored under controlled conditions to prevent degradation or contamination. Proper personal protective equipment (PPE) should be used during handling to ensure compliance with occupational health and safety standards.

Looking ahead, the continued exploration of BENZENAMINE, 4-BROMO-OXOPROPOXY-FLOOR's properties is expected to unlock new avenues for its application in diverse fields. Its role as a key intermediate in drug development and materials science underscores its significance in modern chemical research.

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