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Di-μ-chlorobis[(1,2,3-η)-1-phenyl-2-propenyl]dipalladium(II), 98%

Di-μ-chlorobis[(1,2,3-η)-1-phenyl-2-propenyl]dipalladium(II), 98%

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Molecular Formula:

[(C9H9)ClPd]2

Molecular Weight:

518.08

CAS Number:

12131-44-1

Catalog Number:

12131-44-1

Product Information

Molecular Formula:

[(C9H9)ClPd]2

Molecular Weight:

518.08

Description

Palladium(π-cinnamyl) chloride dimer can be used as a catalyst for the:• Ammonia cross-coupling reactions to synthesize arylamines.• Conversion of aryl triflates to fluorides.It can also be used as a source of palladium in the asymmetric α-arylation of amides.

Synonyms

Bis[cinnamyl palladium(II) chloride],Palladium(1-phenylallyl)chloride dimer,[(Cinnamyl)PdCl]2,[Pd(1-phenylallyl)Cl]2

IUPAC Name

palladium(2+)prop-2-enylbenzenedichloride

Canonical SMILES

C=C[CH-]C1=CC=CC=C1.C=C[CH-]C1=CC=CC=C1.[Cl-].[Cl-].[Pd+2].[Pd+2]

InChI

InChI=1S/2C9H9.2ClH.2Pd/c2*1-2-6-9-7-4-3-5-8-9/h2*2-8H,1H22*1H/q2*-12*+2/p-2

InChI Key

PHDNDSSMEIRHSI-UHFFFAOYSA-L

Melting Point

218-220 °C

Purity

97%

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

517.88593 g/mol

Monoisotopic Mass

515.88552 g/mol

Topological Polar Surface Area

0Å²

Heavy Atom Count

Formal Charge

Complexity

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

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Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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Di-μ-chlorobis[(1,2,3-η)-1-phenyl-2-propenyl]dipalladium(II), 98%

Product Information

Computed Properties

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