Cas no 1187386-07-7 (3-(3-Fluoro-4-methylphenyl)aniline)

3-(3-Fluoro-4-methylphenyl)aniline is a fluorinated aromatic amine derivative with applications in pharmaceutical and agrochemical synthesis. Its key structural features—a fluorine substituent and a methyl group on the phenyl ring—enhance its reactivity and selectivity in cross-coupling reactions, such as Suzuki or Buchwald-Hartwig aminations. The compound serves as a versatile intermediate for constructing complex molecules, particularly in the development of bioactive compounds. Its stability under standard conditions and compatibility with common organic solvents facilitate handling in laboratory and industrial settings. The presence of both electron-donating (methyl) and electron-withdrawing (fluoro) groups allows fine-tuning of electronic properties in target molecules.
3-(3-Fluoro-4-methylphenyl)aniline structure
1187386-07-7 structure
Product Name:3-(3-Fluoro-4-methylphenyl)aniline
CAS No:1187386-07-7
MF:C13H12FN
MW:201.239486694336
MDL:MFCD12913928
CID:857851
PubChem ID:46739312
Update Time:2025-05-19

3-(3-Fluoro-4-methylphenyl)aniline Chemical and Physical Properties

Names and Identifiers

    • 3'-Fluoro-4'-methyl-[1,1'-biphenyl]-3-amine
    • 3-(3-Fluoro-4-methylphenyl)aniline
    • DTXSID60674923
    • DB-347500
    • BS-23114
    • 1187386-07-7
    • AKOS015853228
    • SB76850
    • SCHEMBL23724076
    • MFCD12913928
    • 3'-Fluoro-4'-methyl[1,1'-biphenyl]-3-amine
    • MDL： MFCD12913928
    • Inchi： 1S/C13H12FN/c1-9-5-6-11(8-13(9)14)10-3-2-4-12(15)7-10/h2-8H,15H2,1H3
    • InChI Key： JFIPPNBURNZKRO-UHFFFAOYSA-N
    • SMILES： FC1C=C(C=CC=1C)C1C=CC=C(C=1)N

Computed Properties

  • Exact Mass: 201.09500
  • Monoisotopic Mass: 201.095377549g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 207
  • 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: 3.3
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • PSA: 26.02000
  • LogP: 3.96450

3-(3-Fluoro-4-methylphenyl)aniline 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%

3-(3-Fluoro-4-methylphenyl)aniline Pricemore >>

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SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
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abcr
AB270777-1 g
3-(3-Fluoro-4-methylphenyl)aniline; 98%
 1187386-07-7
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3-(3-Fluoro-4-methylphenyl)aniline Suppliers

Amadis Chemical Company Limited
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Audited Supplier Audited Supplier
(CAS:1187386-07-7)3-(3-Fluoro-4-methylphenyl)aniline
Order Number:A892967
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 11:42
Price ($):273.0

3-(3-Fluoro-4-methylphenyl)aniline Related Literature

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Additional information on 3-(3-Fluoro-4-methylphenyl)aniline

Professional Introduction to 3-(3-Fluoro-4-methylphenyl)aniline (CAS No: 1187386-07-7)

3-(3-Fluoro-4-methylphenyl)aniline (CAS No: 1187386-07-7) is a significant compound in the field of pharmaceutical chemistry, characterized by its unique structural and functional properties. This compound has garnered considerable attention due to its potential applications in drug development and medicinal chemistry. The presence of both fluoro and methyl substituents in its aromatic ring system imparts distinct chemical reactivity and biological activity, making it a valuable intermediate in synthetic chemistry.

The structural framework of 3-(3-Fluoro-4-methylphenyl)aniline consists of a benzene ring substituted with a fluoro group at the 3-position and a methyl group at the 4-position, coupled with an aniline moiety at the 3-position. This specific arrangement enhances its interaction with biological targets, including enzymes and receptors, which is crucial for developing novel therapeutic agents. The fluoro substituent, in particular, is well-known for its ability to modulate metabolic stability, binding affinity, and pharmacokinetic properties of pharmaceutical compounds.

In recent years, 3-(3-Fluoro-4-methylphenyl)aniline has been extensively studied for its role in the synthesis of various pharmacologically active molecules. Its versatility as a building block allows for the creation of complex derivatives with tailored properties. For instance, researchers have explored its use in developing kinase inhibitors, which are essential in treating cancers and inflammatory diseases. The methyl group enhances lipophilicity, while the fluoro group improves metabolic resistance, making this compound an attractive candidate for drug design.

The pharmaceutical industry has leveraged the unique characteristics of 3-(3-Fluoro-4-methylphenyl)aniline to create novel therapeutic agents. One notable application is in the development of small-molecule inhibitors targeting specific protein kinases. These inhibitors have shown promise in preclinical studies for their ability to modulate signaling pathways involved in cell growth and survival. The compound's ability to interact with biological targets with high specificity makes it a valuable tool in rational drug design.

In addition to its applications in oncology, 3-(3-Fluoro-4-methylphenyl)aniline has been investigated for its potential in treating neurological disorders. The structural features of this compound allow it to cross the blood-brain barrier, which is essential for developing effective treatments for central nervous system disorders. Recent studies have highlighted its role in developing neuroprotective agents and antipsychotic drugs. The presence of both fluoro and methyl> groups contributes to its ability to interact with neurotransmitter receptors and modulate neuronal activity.

The synthetic methodologies for preparing 3-(3-

The impact of 3-(3-

Ongoing research continues to explore new applications and derivatives of 3-(3-. Advances in computational chemistry and high-throughput screening techniques are accelerating the discovery process by enabling rapid assessment of molecular interactions. These tools are being used to identify new therapeutic targets and optimize existing drug candidates based on 3-(3-. Such innovations are expected to yield novel treatments for a wide range of diseases.

In conclusion, 3-(3-

1187386-07-7 (3-(3-Fluoro-4-methylphenyl)aniline) Related Products

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Amadis Chemical Company Limited
(CAS:1187386-07-7)3-(3-Fluoro-4-methylphenyl)aniline
A892967
Purity:99%
Quantity:5g
Price ($):273.0
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