Cas no 1020252-06-5 (3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one)

3-[(2-Bromophenyl)amino]-5-phenylcyclohex-2-en-1-one is a brominated aniline-substituted cyclohexenone derivative with potential applications in organic synthesis and pharmaceutical research. Its structure features a conjugated enone system and a 2-bromophenylamino substituent, which may enhance reactivity in nucleophilic or cross-coupling reactions. The phenyl group at the 5-position contributes to steric and electronic modulation, making it a versatile intermediate for constructing complex heterocycles or functionalized scaffolds. This compound’s well-defined molecular architecture offers opportunities for further derivatization, particularly in medicinal chemistry for probing structure-activity relationships. Its crystalline nature ensures consistent purity, facilitating reproducible results in synthetic workflows.
3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one structure
1020252-06-5 structure
Product Name:3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one
CAS No:1020252-06-5
MF:C18H16BrNO
MW:342.22974395752
MDL:MFCD00170453
CID:4567964
Update Time:2025-11-02

3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one Chemical and Physical Properties

Names and Identifiers

    • 3-((2-BROMOPHENYL)AMINO)-5-PHENYLCYCLOHEX-2-EN-1-ONE
    • 2-Cyclohexen-1-one, 3-[(2-bromophenyl)amino]-5-phenyl-
    • 3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one
    • MDL: MFCD00170453
    • Inchi: 1S/C18H16BrNO/c19-17-8-4-5-9-18(17)20-15-10-14(11-16(21)12-15)13-6-2-1-3-7-13/h1-9,12,14,20H,10-11H2
    • InChI Key: LVOKDOZCATUOJX-UHFFFAOYSA-N
    • SMILES: C1(=O)CC(C2=CC=CC=C2)CC(NC2=CC=CC=C2Br)=C1

Computed Properties

  • Exact Mass: 341.04153g/mol
  • Monoisotopic Mass: 341.04153g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 3
  • Complexity: 400
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Molecular Weight: 342.2g/mol
  • XLogP3: 4.2
  • Topological Polar Surface Area: 29.1?2

3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Ambeed
A960194-1g
3-[(2-Bromophenyl)amino]-5-phenylcyclohex-2-en-1-one
1020252-06-5 90%
1g
$348.0 2024-04-26
A2B Chem LLC
AI77629-1mg
3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one
1020252-06-5 >90%
1mg
$201.00 2024-04-20
A2B Chem LLC
AI77629-5mg
3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one
1020252-06-5 >90%
5mg
$214.00 2024-04-20
A2B Chem LLC
AI77629-10mg
3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one
1020252-06-5 >90%
10mg
$240.00 2024-04-20
abcr
AB160371-1 g
3-((2-Bromophenyl)amino)-5-phenylcyclohex-2-en-1-one
1020252-06-5
1g
€194.80 2022-03-05
abcr
AB160371-2 g
3-((2-Bromophenyl)amino)-5-phenylcyclohex-2-en-1-one
1020252-06-5
2g
€253.50 2022-03-05
abcr
AB160371-5 g
3-((2-Bromophenyl)amino)-5-phenylcyclohex-2-en-1-one
1020252-06-5
5g
€370.50 2022-03-05
abcr
AB160371-10 g
3-((2-Bromophenyl)amino)-5-phenylcyclohex-2-en-1-one
1020252-06-5
10g
€487.50 2022-03-05
SHANG HAI BI DE YI YAO KE JI GU FEN Co., Ltd.
BD00943356-1g
3-[(2-Bromophenyl)amino]-5-phenylcyclohex-2-en-1-one
1020252-06-5 90%
1g
¥2394.0 2023-04-06
abcr
AB160371-1g
3-((2-Bromophenyl)amino)-5-phenylcyclohex-2-en-1-one; .
1020252-06-5
1g
€211.20 2025-04-22

3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:1020252-06-5)3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one
Order Number:A1096444
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 20:18
Price ($):313.0

Additional information on 3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one

Comprehensive Overview of 3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one (CAS No. 1020252-06-5)

3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one, with the CAS number 1020252-06-5, is a specialized organic compound that has garnered significant attention in pharmaceutical and chemical research. This compound belongs to the class of cyclohexenone derivatives, which are known for their versatile applications in drug discovery and material science. The presence of both a bromophenyl and a phenyl group in its structure makes it a valuable intermediate for synthesizing more complex molecules.

The compound's unique structure, featuring a cyclohexenone core substituted with an amino and a phenyl group, contributes to its potential utility in medicinal chemistry. Researchers are particularly interested in its role as a building block for developing novel therapeutics, especially in the fields of oncology and neurology. The bromine atom in its structure also offers opportunities for further functionalization, making it a versatile candidate for cross-coupling reactions and other synthetic transformations.

In recent years, the demand for 3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one has increased due to its relevance in high-throughput screening and drug discovery programs. Its ability to interact with various biological targets has made it a subject of interest in the development of kinase inhibitors and GPCR modulators. These applications align with current trends in personalized medicine and targeted therapies, which are among the most searched topics in the pharmaceutical industry.

From a synthetic perspective, the compound's cyclohexenone moiety is particularly noteworthy. This structural feature is often exploited in the synthesis of natural product analogs and bioactive molecules. The enone functionality allows for diverse chemical modifications, enabling researchers to tailor the compound's properties for specific applications. This adaptability is one of the reasons why 3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one is frequently discussed in academic and industrial research circles.

The compound's physicochemical properties, such as its solubility, stability, and reactivity, are critical factors in its practical applications. Studies have shown that it exhibits moderate solubility in organic solvents like DMSO and methanol, which is advantageous for laboratory-scale experiments. Its stability under ambient conditions further enhances its usability as a research chemical. These characteristics are often highlighted in user queries related to compound handling and storage, making it a relevant topic for discussion.

In the context of green chemistry, researchers are exploring sustainable methods for synthesizing 3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one. This aligns with the growing emphasis on eco-friendly synthesis and reduced waste generation in chemical manufacturing. The compound's potential for catalytic transformations and atom-efficient reactions is a hot topic in contemporary chemical literature, reflecting broader industry trends toward sustainability.

Another area of interest is the compound's role in computational chemistry and molecular modeling. Its well-defined structure and predictable reactivity make it an excellent candidate for in silico studies, which are increasingly used to accelerate drug discovery. This aspect is particularly relevant given the rising popularity of AI-driven drug design and machine learning in pharmaceutical research, topics that frequently appear in search engine queries.

Market analysts have noted a steady increase in the availability of 3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one from specialty chemical suppliers. This trend reflects its growing importance in custom synthesis and contract research organizations. The compound's patent landscape is also evolving, with several applications citing its use in novel therapeutic agents. These developments are closely monitored by professionals in the pharmaceutical and biotechnology sectors.

In summary, 3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one (CAS No. 1020252-06-5) is a multifaceted compound with significant potential in both academic and industrial settings. Its structural features, synthetic versatility, and applicability in drug discovery make it a valuable asset for researchers. As the scientific community continues to explore its properties and applications, this compound is likely to remain a topic of interest in the years to come.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:1020252-06-5)3-[(2-bromophenyl)amino]-5-phenylcyclohex-2-en-1-one
A1096444
Purity:99%
Quantity:1g
Price ($):313.0
Email