Cas no 116941-52-7 (4-Bromo-5'-phenyl-1,1':3',1''-terphenyl)

4-Bromo-5'-phenyl-1,1':3',1''-terphenyl is a brominated terphenyl derivative characterized by its rigid, conjugated aromatic structure. This compound serves as a valuable intermediate in organic synthesis, particularly in the preparation of advanced materials such as liquid crystals, organic semiconductors, and supramolecular architectures. The bromine substituent enhances reactivity, enabling selective cross-coupling reactions like Suzuki or Stille couplings for further functionalization. Its extended π-system contributes to electronic delocalization, making it useful in optoelectronic applications. The phenyl and terphenyl backbone provides thermal and chemical stability, ensuring robustness in demanding synthetic conditions. This compound is typically handled under inert conditions due to its sensitivity to air and moisture.
4-Bromo-5'-phenyl-1,1':3',1''-terphenyl structure
116941-52-7 structure
Product Name:4-Bromo-5'-phenyl-1,1':3',1''-terphenyl
CAS No:116941-52-7
MF:C24H17Br
MW:385.295785665512
MDL:MFCD26407506
CID:1206469
PubChem ID:354333670
Update Time:2025-11-01

4-Bromo-5'-phenyl-1,1':3',1''-terphenyl Chemical and Physical Properties

Names and Identifiers

    • 1,1':3',1''-Terphenyl, 4-bromo-5'-phenyl-
    • 4-Bromo-5'-phenyl-1,1':3',1''-terphenyl
    • 5'-(p-bromophenyl)-[1,1':3',1'']terphenyl
    • 1-BROMO-3,5-DIPHENYLBENZENE
    • 4-Bromo-5'-phenyl-m-terphenyl
    • 5'-(4-Bromophenyl)-m-terphenyl
    • 5'-(4-Bromophenyl)-1,1':3',1''-terphenyl
    • 1-(4-Bromophenyl)-3,5-diphenylbenzene
    • SIAJAYFLPBYCOF-UHFFFAOYSA-N
    • 4-Bromo-5a(2)-phenyl-1,1a(2):3a(2),1a(2)a(2)-terphenyl
    • MFCD26407506
    • AKOS024438161
    • 1,1/':3/',1/'/'-Terphenyl, 4-broMo-5/'-phenyl-
    • BS-43845
    • 3-(4-BROMOPHENYL)-5-PHENYL-1,1'-BIPHENYL
    • 4-Bromo-5 inverted exclamation mark -phenyl-1,1 inverted exclamation mark :3 inverted exclamation mark ,1 inverted exclamation mark inverted exclamation mark -terphenyl
    • A893482
    • T70118
    • 116941-52-7
    • SY055734
    • B4889
    • SCHEMBL4827144
    • DTXSID401281172
    • SB66678
    • 1,1':3',1''-Terphenyl,4-bromo-5'-phenyl-
    • MDL: MFCD26407506
    • Inchi: 1S/C24H17Br/c25-24-13-11-20(12-14-24)23-16-21(18-7-3-1-4-8-18)15-22(17-23)19-9-5-2-6-10-19/h1-17H
    • InChI Key: SIAJAYFLPBYCOF-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(=CC=1)C1C=C(C2C=CC=CC=2)C=C(C2C=CC=CC=2)C=1

Computed Properties

  • Exact Mass: 384.05100
  • Monoisotopic Mass: 384.05136g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 25
  • Rotatable Bond Count: 3
  • Complexity: 359
  • 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: 7.5
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • Density: 1.278±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 148.0 to 152.0 deg-C
  • Boiling Point: 505.1±19.0 °C at 760 mmHg
  • Flash Point: 251.4±15.9 °C
  • Solubility: Insuluble (4.2E-6 g/L) (25 oC),
  • PSA: 0.00000
  • LogP: 7.45010
  • λmax: 255(CH3CN)(lit.)
  • Vapor Pressure: 0.0±1.2 mmHg at 25°C

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4-Bromo-5'-phenyl-1,1':3',1''-terphenyl Suppliers

Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:116941-52-7)1,1':3',1''-Terphenyl, 4-broMo-5'-phenyl-
Order Number:sfd22358
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:39
Price ($):discuss personally

Additional information on 4-Bromo-5'-phenyl-1,1':3',1''-terphenyl

Introduction to 4-Bromo-5'-phenyl-1,1':3',1''-terphenyl (CAS No. 116941-52-7)

4-Bromo-5'-phenyl-1,1':3',1''-terphenyl (CAS No. 116941-52-7) is a complex organic compound that has garnered significant attention in the fields of organic synthesis, materials science, and pharmaceutical research. This compound is characterized by its unique structural features, which include a terphenyl backbone with a bromine substituent and a phenyl group. These structural elements contribute to its diverse applications and potential in various scientific and industrial contexts.

The molecular formula of 4-Bromo-5'-phenyl-1,1':3',1''-terphenyl is C26H19Br, and its molecular weight is 389.33 g/mol. The compound is typically synthesized through multi-step processes involving the coupling of aromatic rings and the introduction of bromine and phenyl groups. Recent advancements in synthetic methodologies have led to more efficient and scalable routes for the production of this compound, making it increasingly accessible for research and development purposes.

In the realm of organic synthesis, 4-Bromo-5'-phenyl-1,1':3',1''-terphenyl serves as a valuable building block for the construction of more complex molecules. Its bromine substituent makes it an excellent precursor for Suzuki-Miyaura coupling reactions, which are widely used in the synthesis of biologically active compounds and functional materials. The phenyl group, on the other hand, imparts additional stability and electronic properties that can be exploited in various applications.

The physical properties of 4-Bromo-5'-phenyl-1,1':3',1''-terphenyl, such as its melting point (approximately 200°C) and solubility in common organic solvents like dichloromethane and toluene, make it suitable for use in a wide range of experimental conditions. These properties have been extensively studied and characterized in recent literature, providing a solid foundation for its application in both academic and industrial settings.

In materials science, 4-Bromo-5'-phenyl-1,1':3',1''-terphenyl has shown promise as a component in the development of organic semiconductors and optoelectronic devices. The terphenyl backbone provides a rigid structure that can enhance charge transport properties, while the bromine substituent can be used to fine-tune the electronic characteristics of the material. Recent studies have demonstrated that compounds with similar structures exhibit high charge carrier mobilities and excellent photoluminescence properties, making them attractive candidates for use in organic light-emitting diodes (OLEDs) and field-effect transistors (FETs).

In the pharmaceutical industry, 4-Bromo-5'-phenyl-1,1':3',1''-terphenyl has been explored as a potential lead compound for drug discovery. Its unique structure allows for the modulation of biological activities through rational design and synthesis of derivatives. For instance, researchers have investigated the use of terphenyl-based compounds as inhibitors of specific enzymes involved in disease pathways. Preliminary studies have shown promising results in terms of potency and selectivity, suggesting that further optimization could lead to the development of novel therapeutic agents.

The environmental impact of 4-Bromo-5'-phenyl-1,1':3',1''-terphenyl is also an important consideration. While it is not classified as a hazardous substance under current regulations, efforts are being made to develop greener synthetic methods that minimize waste generation and reduce environmental footprint. Sustainable chemistry practices are increasingly being adopted in the production of this compound to ensure long-term viability and safety.

In conclusion, 4-Bromo-5'-phenyl-1,1':3',1''-terphenyl (CAS No. 116941-52-7) is a versatile compound with significant potential across multiple scientific disciplines. Its unique structural features make it an invaluable tool in organic synthesis, materials science, and pharmaceutical research. Ongoing studies continue to uncover new applications and optimize its properties for various uses, highlighting its importance in advancing scientific knowledge and technological innovation.

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Suzhou Senfeida Chemical Co., Ltd
(CAS:116941-52-7)1,1':3',1''-Terphenyl, 4-broMo-5'-phenyl-
sfd22358
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
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