Cas no 1261877-97-7 (2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl)

2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl is a specialized biphenyl derivative featuring both trifluoromethoxy and trifluoromethyl substituents, along with an amino functional group. This compound is of interest in pharmaceutical and agrochemical research due to its electron-withdrawing trifluoromethyl and trifluoromethoxy groups, which can enhance metabolic stability and bioavailability. The amino group provides a reactive site for further functionalization, making it a versatile intermediate in synthetic chemistry. Its unique structural properties may contribute to applications in drug discovery, particularly in the development of bioactive molecules with improved pharmacokinetic profiles. The compound's stability and reactivity make it a valuable building block for advanced organic synthesis.
2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl structure
1261877-97-7 structure
Product Name:2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl
CAS No:1261877-97-7
MF:C14H9F6NO
MW:321.217784643173
CID:4790047
Update Time:2025-10-31

2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl Chemical and Physical Properties

Names and Identifiers

    • 2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl
    • Inchi: 1S/C14H9F6NO/c15-13(16,17)8-5-6-11(21)10(7-8)9-3-1-2-4-12(9)22-14(18,19)20/h1-7H,21H2
    • InChI Key: BHEJOSLKSHPUBG-UHFFFAOYSA-N
    • SMILES: FC(C1C=CC(=C(C=1)C1C=CC=CC=1OC(F)(F)F)N)(F)F

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 2
  • Complexity: 369
  • XLogP3: 4.9
  • Topological Polar Surface Area: 35.2

2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A011004130-250mg
2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl
1261877-97-7 97%
250mg
499.20 USD 2021-05-28
Alichem
A011004130-500mg
2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl
1261877-97-7 97%
500mg
855.75 USD 2021-05-28
Alichem
A011004130-1g
2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl
1261877-97-7 97%
1g
1,475.10 USD 2021-05-28

Additional information on 2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl

2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl: A Comprehensive Overview

The compound 2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl, identified by the CAS number 1261877-97-7, is a highly specialized organic molecule with significant potential in various fields of research and application. This compound belongs to the class of biphenyl derivatives, which are widely studied due to their unique electronic properties and structural versatility. The molecule's structure comprises two phenyl rings connected by a single bond, with substituents that include an amino group, a trifluoromethoxy group, and a trifluoromethyl group. These substituents contribute to the compound's distinct chemical and physical properties, making it a subject of interest in both academic and industrial research.

Recent advancements in synthetic chemistry have enabled the efficient synthesis of this compound, leveraging innovative methodologies such as Suzuki coupling reactions and palladium-catalyzed cross-couplings. These techniques have not only improved the yield and purity of the compound but also opened new avenues for its application in drug discovery and materials science. The presence of electron-withdrawing groups like trifluoromethoxy and trifluoromethyl significantly influences the electronic characteristics of the biphenyl system, enhancing its stability and reactivity under various conditions.

In terms of physical properties, 2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl exhibits a high melting point due to the strong intermolecular forces arising from its fluorinated substituents. The compound is also known for its excellent solubility in polar solvents, which makes it suitable for use in various analytical techniques such as high-performance liquid chromatography (HPLC) and nuclear magnetic resonance (NMR) spectroscopy. Its thermal stability further underscores its potential as a building block in the synthesis of more complex molecules.

The application of this compound extends into several domains, including pharmaceuticals, agrochemicals, and electronic materials. In the pharmaceutical industry, biphenyl derivatives like this one are often explored for their potential as kinase inhibitors or modulators of cellular signaling pathways. Recent studies have highlighted its ability to inhibit specific protein kinases involved in cancer cell proliferation, suggesting its role as a lead compound in anticancer drug development.

In the field of agrochemistry, the compound's electron-withdrawing groups make it an attractive candidate for herbicide development. Its ability to disrupt key biochemical pathways in weeds without adversely affecting crops has been demonstrated in preliminary trials. Furthermore, its fluorinated substituents contribute to enhanced bioavailability and reduced toxicity, making it a promising candidate for future agricultural applications.

The electronic properties of 2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl also make it relevant in materials science, particularly in the development of organic semiconductors and light-emitting diodes (LEDs). Its ability to undergo charge transfer interactions under UV irradiation has been leveraged in designing novel optoelectronic materials with improved efficiency and stability.

From a research perspective, this compound serves as a valuable model system for studying fluorinated aromatic compounds. Its structure allows researchers to investigate the effects of fluorination on aromaticity, electron distribution, and reactivity. Recent computational studies using density functional theory (DFT) have provided insights into its electronic structure and reactivity patterns, further enhancing our understanding of fluorinated biphenyl systems.

In conclusion, 2-Amino-2'-(trifluoromethoxy)-5-(trifluoromethyl)biphenyl is a multifaceted compound with significant implications across diverse scientific disciplines. Its unique chemical structure, coupled with recent advancements in synthesis and application techniques, positions it as a key player in modern chemical research. As ongoing studies continue to uncover new potentials for this compound, its role in driving innovation across industries is expected to grow significantly.

Recommended suppliers
上海嶸奧生物技術(shù)有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
上海嶸奧生物技術(shù)有限公司
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Xiamen PinR Bio-tech Co., Ltd.
Hangzhou Cedareal Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Hangzhou Cedareal Technology Co., Ltd.
Shenzhen Yaoyuan R&D Center Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shenzhen Yaoyuan R&D Center Co.,Ltd
Handan Zechi Trading Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk