Cas no 725745-08-4 (Dichlorobis(chlorodi-tert-butylphosphine)palladium(II))

Dichlorobis(chlorodi-tert-butylphosphine)palladium(II) is a highly stable palladium(II) complex featuring bulky tert-butylphosphine ligands. Its sterically hindered structure enhances air and moisture stability while maintaining reactivity in cross-coupling reactions, such as Suzuki-Miyaura and Buchwald-Hartwig couplings. The electron-rich phosphine ligands facilitate oxidative addition and stabilize the palladium center, improving catalytic efficiency. This compound is particularly useful for demanding transformations requiring robust catalysts under mild conditions. Its well-defined structure ensures reproducibility in synthetic applications, making it a preferred choice for researchers in organometallic chemistry and pharmaceutical development. The complex is typically handled under inert atmospheres to preserve its integrity.
Dichlorobis(chlorodi-tert-butylphosphine)palladium(II) structure
725745-08-4 structure
Product Name:Dichlorobis(chlorodi-tert-butylphosphine)palladium(II)
CAS No:725745-08-4
MF:C16H36Cl4P2Pd
MW:538.636561393738
MDL:MFCD05662698
CID:562529
Update Time:2025-06-30

Dichlorobis(chlorodi-tert-butylphosphine)palladium(II) Chemical and Physical Properties

Names and Identifiers

    • Palladium,bis[bis(1,1-dimethylethyl)phosphinous chloride-kP]dichloro- (9CI)
    • Dichlorobis(chlorodi-tert-butylphosphine) palladium(II)
    • PXPD
    • dichlorobis(chlorodi-tert-butylphosphine)palladium(ii)
    • ditert-butyl(chloro)phosphane;dichloropalladium
    • Dichlorobis(chlorodi-tert-butylphosphine) palladium
    • Dichlorobis(chlorodi-tert-butylphosphine)palladium (ii)
    • DICHLOROBIS(CHLORODI-TERT-BUTYLPHOSPHINE) PALLADIUM (II)
    • dichlorobis(chlorodi-tert-butylphosphine) palladium (ii), AldrichCPR
    • Dichlorobis(chlorodi-tert-butylphosphine)palladium(II)
    • MDL: MFCD05662698
    • Inchi: 1S/2C8H18ClP.2ClH.Pd/c2*1-7(2,3)10(9)8(4,5)6;;;/h2*1-6H3;2*1H;/q;;;;+2/p-2
    • InChI Key: SBVNVPYALHOWLN-UHFFFAOYSA-L
    • SMILES: [Pd](Cl)Cl.ClP(C(C)(C)C)C(C)(C)C.ClP(C(C)(C)C)C(C)(C)C

Computed Properties

  • Exact Mass: 536.00800
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 4
  • Complexity: 96.2
  • Topological Polar Surface Area: 0

Experimental Properties

  • PSA: 27.18000
  • LogP: 9.81720

Dichlorobis(chlorodi-tert-butylphosphine)palladium(II) Security Information

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Additional information on Dichlorobis(chlorodi-tert-butylphosphine)palladium(II)

Dichlorobis(chlorodi-tert-butylphosphine)palladium(II): A Comprehensive Overview

Dichlorobis(chlorodi-tert-butylphosphine)palladium(II), also known by its CAS No 725745-08-4, is a significant compound in the field of organometallic chemistry. This compound has garnered considerable attention due to its unique properties and applications in catalytic processes. The structure of this compound is characterized by a palladium(II) center coordinated with two chlorides and two chlorodi-tert-butylphosphine ligands, which impart it with exceptional stability and reactivity.

The synthesis of Dichlorobis(chlorodi-tert-butylphosphine)palladium(II) involves the reaction of palladium chloride with chlorodi-tert-butylphosphine in a controlled environment. The resulting compound exhibits a bright yellow color and is highly soluble in organic solvents, making it ideal for various chemical reactions. Recent studies have highlighted its role as an efficient catalyst in cross-coupling reactions, particularly in the presence of aryl halides and alkenes.

One of the most notable applications of this compound is in the field of organic synthesis. Researchers have demonstrated its ability to facilitate Suzuki-Miyaura couplings, which are crucial for the construction of biaryl compounds. These compounds are widely used in the pharmaceutical industry for drug development. The use of Dichlorobis(chlorodi-tert-butylphosphine)palladium(II) as a catalyst has significantly improved the yield and selectivity of these reactions, making it a preferred choice among chemists.

In addition to its catalytic applications, this compound has also found utility in homogeneous catalysis for hydrogenation reactions. Its ability to activate hydrogen under mild conditions has made it a valuable tool in the synthesis of complex organic molecules. Recent advancements have shown that by modifying the ligands attached to the palladium center, the selectivity and activity of the catalyst can be further enhanced.

The stability of Dichlorobis(chlorodi-tert-butylphosphine)palladium(II) under various reaction conditions is another factor that contributes to its widespread use. Unlike some other palladium catalysts, this compound remains stable even when exposed to air and moisture, which simplifies its handling and storage.

From an environmental standpoint, the use of this compound aligns with the principles of green chemistry due to its high efficiency and reduced waste generation during reactions. Its ability to operate under mild conditions also minimizes energy consumption, making it an eco-friendly alternative to traditional catalysts.

In conclusion, Dichlorobis(chlorodi-tert-butylphosphine)palladium(II) stands out as a versatile and efficient catalyst with a wide range of applications in organic synthesis and catalytic processes. Its unique properties, combined with recent advancements in its application techniques, ensure that it will continue to play a pivotal role in both academic research and industrial chemical production.

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