[2'-(methylamino)-[1,1'-biphenyl]-2-yl]palladio methanesulfonate, dicyclohexyl[2',4',6'-tris(propan-2-yl)-[1,1'-biphenyl]-2-yl]phosphane | CAS No. 1599466-81-5

[2'-(methylamino)-[1,1'-biphenyl]-2-yl]palladio methanesulfonate, dicyclohexyl[2',4',6'-tris(propan-2-yl)-[1,1'-biphenyl]-2-yl]phosphane

Basic Information

CAS Number

1599466-81-5

Molecular Formula

C47H64NO3PPdS

Molecular Weight

860.49 g/mol

AD

Basic Physical Properties

CNc1ccccc1c2ccccc2[Pd]OS(=O)(=O)C.CC(C)c1cc(C(C)C)c(c(c1)C(C)C)c2ccccc2P(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C33H49P.C13H12N.CH4O3S.Pd/c1-23(2)26-21-30(24(3)4)33(31(22-26)25(5)6)29-19-13-14-20-32(29)34(27-15-9-7-10-16-27)28-17-11-8-12-18-28;1-14-13-10-6-5-9-12(13)11-7-3-2-4-8-11;1-5(2,3)4;/h13-14,19-25,27-28H,7-12,15-18H2,1-6H3;2-7,9-10,14H,1H3;1H3,(H,2,3,4);/q;;;+1/p-1

InChIKey

LJYHQNMVCGMPIU-UHFFFAOYSA-M

LogP

12.49069999999998

Topological Polar Surface Area

55.4 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Synonyms & References

English

  • Methanesulfonato(2-dicyclohexylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl)(2'-methylamino-1,1'-biphenyl-2-yl)palladium(II)
  • XPhos Pd G4

MDL Number

MFCD29049345

FAQ

What are the physical and chemical properties of [2'-(methylamino)-[1,1'-biphenyl]-2-yl]palladio methanesulfonate, dicyclohexyl[2',4',6'-tris(propan-2-yl)-[1,1'-biphenyl]-2-yl]phosphane (CAS: 1599466-81-5)?

The compound is a crystalline solid with a high molecular weight. It has limited water solubility but good solubility in organic solvents. It is highly reactive due to the presence of the palladium and phosphane ligands. The compound can undergo various transformations under mild conditions, making it useful in organic synthesis.

How is [2'-(methylamino)-[1,1'-biphenyl]-2-yl]palladio methanesulfonate, dicyclohexyl[2',4',6'-tris(propan-2-yl)-[1,1'-biphenyl]-2-yl]phosphane (CAS: 1599466-81-5) typically synthesized?

This compound is typically synthesized through a multi-step process involving palladium catalysis, using methanesulfonic acid as a ligand to activate the palladium center. The reaction involves coupling of the biphenyl derivatives with phosphine ligands under controlled conditions to achieve high yields and selectivity.

What industries use [2'-(methylamino)-[1,1'-biphenyl]-2-yl]palladio methanesulfonate, dicyclohexyl[2',4',6'-tris(propan-2-yl)-[1,1'-biphenyl]-2-yl]phosphane (CAS: 1599466-81-5)?

This compound is primarily used in the pharmaceutical and chemical industries for its catalytic properties in organic synthesis. It is also relevant in polymer chemistry and for developing new materials due to its reactivity and stability.

What precautions should be taken when handling [2'-(methylamino)-[1,1'-biphenyl]-2-yl]palladio methanesulfonate, dicyclohexyl[2',4',6'-tris(propan-2-yl)-[1,1'-biphenyl]-2-yl]phosphane (CAS: 1599466-81-5)?

Proper handling requires the use of personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be done in a fume hood to minimize exposure. Spills should be cleaned up using appropriate absorbents, and the area should be well-ventilated. Always refer to the Safety Data Sheet (SDS) for specific handling instructions and emergency procedures.

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