Cas no 405-68-5 (2-(4-Fluoro-phenyl)-ethyl-methyl-amine)

2-(4-Fluoro-phenyl)-ethyl-methyl-amine is a fluorinated phenethylamine derivative with potential applications in pharmaceutical and chemical research. Its structure features a fluorine substituent on the phenyl ring, which can enhance metabolic stability and influence binding affinity in bioactive compounds. The ethyl-methyl-amine moiety provides versatility for further functionalization, making it a valuable intermediate in medicinal chemistry. The fluorine atom's electron-withdrawing properties may improve lipophilicity and bioavailability, while the amine group allows for derivatization into salts or other active forms. This compound is suitable for use in drug discovery, particularly in the development of CNS-targeting agents or fluorinated analogs of known pharmacophores. Proper handling under controlled conditions is recommended due to its reactive amine functionality.
2-(4-Fluoro-phenyl)-ethyl-methyl-amine structure
405-68-5 structure
Product Name:2-(4-Fluoro-phenyl)-ethyl-methyl-amine
CAS No:405-68-5
MF:C9H13ClFN
MW:189.657624959946
CID:333712
PubChem ID:120233
Update Time:2025-05-23

2-(4-Fluoro-phenyl)-ethyl-methyl-amine Chemical and Physical Properties

Names and Identifiers

    • Benzeneethanamine,4-fluoro-N-methyl-, hydrochloride (1:1)
    • [2-(4-FLUORO-PHENYL)-ETHYL]-METHYL-AMINE
    • p-Fluoro-N-methylphenethylamine hydrochloride
    • 4-Fluoro-N-methylbenzeneethanamine hydrochloride
    • p-fluoro-n-methyl-phenethylaminhydrochloride
    • DTXSID80960895
    • Phenethylamine, p-fluoro-N-methyl-, hydrochloride
    • [2-(4-fluorophenyl)ethyl](methyl)amine hydrochloride
    • BENZENEETHANAMINE, 4-FLUORO-N-METHYL-, HYDROCHLORIDE
    • UNII-8SET5RSQ6R
    • 2-(4-fluorophenyl)-N-methylethanamine;hydrochloride
    • EN300-6478442
    • N-METHYL-P-FLUOROPHENETHYLAMINE HYDROCHLORIDE
    • Q27270964
    • 2-(4-Fluorophenyl)-N-methylethan-1-amine--hydrogen chloride (1/1)
    • 405-68-5
    • 8SET5RSQ6R
    • BENZENEETHANAMINE, 4-FLUORO-N-METHYL-, HYDROCHLORIDE (1:1)
    • P-FLUORO-N-METHYL-PHENETHYLAMINE HYDROCHLORIDE
    • 2-(4-Fluoro-phenyl)-ethyl-methyl-amine
    • Inchi: 1S/C9H12FN.ClH/c1-11-7-6-8-2-4-9(10)5-3-8;/h2-5,11H,6-7H2,1H3;1H
    • InChI Key: IAMHNHXYJUTVDY-UHFFFAOYSA-N
    • SMILES: Cl.FC1C=CC(=CC=1)CCNC

Computed Properties

  • Exact Mass: 153.09500
  • Monoisotopic Mass: 189.0720553g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 97.7
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 12?2

Experimental Properties

  • PSA: 12.03000
  • LogP: 1.97850

2-(4-Fluoro-phenyl)-ethyl-methyl-amine Security Information

2-(4-Fluoro-phenyl)-ethyl-methyl-amine 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%

2-(4-Fluoro-phenyl)-ethyl-methyl-amine Pricemore >>

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Additional information on 2-(4-Fluoro-phenyl)-ethyl-methyl-amine

2-(4-Fluoro-phenyl)-ethyl-methyl-amine (CAS No. 405-68-5): Properties, Applications, and Market Insights

2-(4-Fluoro-phenyl)-ethyl-methyl-amine (CAS No. 405-68-5) is a fluorinated aromatic amine with significant interest in pharmaceutical and chemical research. This compound, also known as 4-fluoro-N-methylphenethylamine, features a phenyl ring substituted with a fluorine atom at the para position, coupled with an ethyl-methyl-amine side chain. Its unique structure makes it a valuable intermediate in organic synthesis and drug development.

The chemical properties of 2-(4-Fluoro-phenyl)-ethyl-methyl-amine include a molecular formula of C9H12FN and a molecular weight of 153.20 g/mol. The presence of the fluoro group enhances its lipophilicity, which is crucial for bioavailability in pharmaceutical applications. Researchers often explore its potential as a building block for central nervous system (CNS) active compounds, given its structural similarity to neurotransmitters like dopamine and serotonin.

In recent years, the demand for fluorinated organic compounds has surged due to their applications in medicinal chemistry. 2-(4-Fluoro-phenyl)-ethyl-methyl-amine is no exception, with studies highlighting its role in synthesizing novel psychoactive substances and neuroprotective agents. The compound's stability and reactivity make it a preferred choice for researchers investigating neurological disorders and mood regulation.

From a market perspective, the global interest in fluoro-phenyl derivatives is driven by advancements in personalized medicine and CNS drug development. Companies specializing in fine chemicals and pharmaceutical intermediates are increasingly stocking 2-(4-Fluoro-phenyl)-ethyl-methyl-amine to meet research demands. Its compatibility with modern synthetic techniques, such as flow chemistry and catalyzed cross-coupling reactions, further enhances its appeal.

One of the trending topics in chemical research is the exploration of sustainable synthesis methods for fluorinated compounds. 2-(4-Fluoro-phenyl)-ethyl-methyl-amine is often discussed in the context of green chemistry, where researchers aim to minimize waste and energy consumption. Innovations like electrochemical fluorination and biocatalytic approaches are being tested to produce this compound more efficiently.

Safety and regulatory compliance are critical when handling 2-(4-Fluoro-phenyl)-ethyl-methyl-amine. While it is not classified as a hazardous substance, proper laboratory practices, including the use of personal protective equipment (PPE) and fume hoods, are recommended. Researchers should also stay updated on regional regulations regarding the use and disposal of fluorinated compounds.

In summary, 2-(4-Fluoro-phenyl)-ethyl-methyl-amine (CAS No. 405-68-5) is a versatile compound with growing importance in pharmaceutical and chemical research. Its applications in CNS drug development, coupled with advancements in sustainable synthesis, position it as a key player in modern chemistry. As the demand for fluorinated intermediates rises, this compound is likely to remain a focal point for innovation and discovery.

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