Cas no 55096-88-3 (benzyl(4-fluorophenyl)methylamine)

Benzyl(4-fluorophenyl)methylamine is a fluorinated aromatic amine compound with potential applications in pharmaceutical and agrochemical synthesis. Its structure features a benzyl group and a 4-fluorophenyl moiety, offering versatility as a building block for further functionalization. The fluorine substituent enhances electron-withdrawing properties, influencing reactivity in nucleophilic or electrophilic reactions. This compound may serve as an intermediate in the development of bioactive molecules, including CNS-active agents or enzyme inhibitors. Its stability under standard conditions and compatibility with common organic reactions make it a practical choice for research and industrial applications. Proper handling is advised due to potential amine-related hazards.
benzyl(4-fluorophenyl)methylamine structure
55096-88-3 structure
Product Name:benzyl(4-fluorophenyl)methylamine
CAS No:55096-88-3
MF:C14H14FN
MW:215.266067028046
MDL:MFCD00716882
CID:375652
PubChem ID:784761
Update Time:2025-10-30

benzyl(4-fluorophenyl)methylamine Chemical and Physical Properties

Names and Identifiers

    • N-Benzyl-1-(4-fluorophenyl)methanamine
    • Benzyl-(4-Fluorobenzyl)Amine
    • N-Benzyl-4-fluorobenzylamine
    • Benzenemethanamine,4-fluoro-N-(phenylmethyl)-
    • Benzyl-(4-fluoro-benzyl)-amine
    • N-[(4-fluorophenyl)methyl]-1-phenylmethanamine
    • [(4-fluorophenyl)methyl]benzylamine
    • 1-Fluorodibenzylamin
    • 4-fluorobenzylbenzylamine
    • 4-fluorodibenzylamine
    • BzINH(Bzl-4-F)
    • N-benzyl-1-(4-fluorophenyl)methanamine(SALTDATA: HCl)
    • benzyl(4-fluorophenyl)methylamine
    • EN300-32608
    • HMS1686P04
    • DTXSID50354843
    • SR-01000363762-1
    • benzyl[(4-fluorophenyl)methyl]amine
    • SR-01000363762
    • Oprea1_619682
    • O3G
    • A830483
    • W18469
    • MFCD00716882
    • SCHEMBL1038941
    • AKOS000227349
    • SB78758
    • SXZSRGKJZKOZRP-UHFFFAOYSA-N
    • FT-0640291
    • 55096-88-3
    • Z57329001
    • STL119880
    • MDL: MFCD00716882
    • Inchi: 1S/C14H14FN/c15-14-8-6-13(7-9-14)11-16-10-12-4-2-1-3-5-12/h1-9,16H,10-11H2
    • InChI Key: SXZSRGKJZKOZRP-UHFFFAOYSA-N
    • SMILES: FC1C=CC(=CC=1)CNCC1C=CC=CC=1

Computed Properties

  • Exact Mass: 215.11100
  • Monoisotopic Mass: 215.111027613g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 181
  • 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: 2.8
  • Topological Polar Surface Area: 12?2

Experimental Properties

  • PSA: 12.03000
  • LogP: 3.50640

benzyl(4-fluorophenyl)methylamine Security Information

  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT

benzyl(4-fluorophenyl)methylamine Customs Data

  • HS CODE:2921499090
  • Customs Data:

    China Customs Code:

    2921499090

    Overview:

    2921499090 Other aromatic monoamines and derivatives and their salts. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2921499090 other aromatic monoamines and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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benzyl(4-fluorophenyl)methylamine Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:55096-88-3)benzyl(4-fluorophenyl)methylamine
Order Number:A830483
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 15:17
Price ($):451.0

Additional information on benzyl(4-fluorophenyl)methylamine

Comprehensive Overview of Benzyl(4-fluorophenyl)methylamine (CAS No. 55096-88-3): Properties, Applications, and Industry Insights

Benzyl(4-fluorophenyl)methylamine (CAS No. 55096-88-3) is a fluorinated aromatic amine derivative with a molecular structure that combines a benzyl group, a fluorophenyl ring, and a methylamine moiety. This compound has garnered significant attention in pharmaceutical and agrochemical research due to its unique structural features, which enable diverse functional applications. The presence of the 4-fluorophenyl group enhances its electronic properties, making it a valuable intermediate in synthetic chemistry. Researchers frequently explore its potential in drug discovery, particularly for designing central nervous system (CNS)-targeted molecules, given its ability to modulate bioavailability and blood-brain barrier permeability.

In recent years, the demand for fluorinated organic compounds like benzyl(4-fluorophenyl)methylamine has surged, driven by their stability and metabolic resistance in biological systems. This aligns with the growing trend of precision medicine and structure-activity relationship (SAR) studies, where subtle modifications in molecular architecture can significantly alter pharmacological profiles. A common query among chemists is: "How does fluorination impact the reactivity of benzylamine derivatives?" The answer lies in the electron-withdrawing nature of fluorine, which influences the compound’s polarity, lipophilicity, and interaction with biological targets. Such insights are critical for optimizing high-throughput screening (HTS) workflows in drug development.

From an industrial perspective, CAS No. 55096-88-3 is often utilized as a building block for synthesizing more complex molecules. Its applications extend to materials science, where fluorinated aromatics contribute to the development of advanced polymers and liquid crystals. Notably, the compound’s thermal stability and compatibility with cross-coupling reactions (e.g., Suzuki-Miyaura or Buchwald-Hartwig) make it a preferred choice for catalyzed organic transformations. Environmental considerations also play a role; researchers are increasingly investigating green chemistry approaches to minimize waste during its production, addressing the broader industry shift toward sustainable synthesis.

Analytical characterization of benzyl(4-fluorophenyl)methylamine typically involves techniques such as nuclear magnetic resonance (NMR), high-performance liquid chromatography (HPLC), and mass spectrometry (MS). These methods ensure purity and compliance with regulatory standards, a topic frequently searched by quality control professionals. Another trending question is: "What are the storage conditions for fluorinated amines to prevent degradation?" Best practices recommend inert atmospheres and low-temperature storage to preserve the compound’s integrity, reflecting the importance of chemical stability in long-term applications.

Looking ahead, the versatility of 55096-88-3 positions it as a key player in interdisciplinary research. Innovations in catalysis and bioconjugation techniques are expected to expand its utility further. For instance, its potential in proteolysis-targeting chimeras (PROTACs)—a breakthrough in targeted protein degradation—highlights its relevance in cutting-edge therapeutics. As the scientific community continues to explore structure-based drug design, this compound’s role in addressing undruggable targets remains a compelling area of study.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:55096-88-3)benzyl(4-fluorophenyl)methylamine
A830483
Purity:99%
Quantity:1g
Price ($):451.0
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