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Allylpalladium(II) chloride dimer - Pd 58.2%, high purity , CAS No.12012-95-2

COA

Grade & Purity:

Pd 58.2%

Cas Number: 12012-95-2
Molecular Weight: 365.89
Beilstein Registry Number: 4124623
EC Number: 234-579-8
MDL number: MFCD00044874
PubChem CID: 61538
PubChem SID: 504753787

In stock

Item Number

A101182

Grouped product items
SKU	Size	Availability	Price
A101182-250mg	250mg	4	$34.90
A101182-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$106.90
A101182-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$371.90

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Element classified compounds (2014) Palladium catalyst (83)

Basic Description

Synonyms	[Pd(allyl)Cl]2 \| Bis((eta3-allyl)(chloro)palladium) \| Bis((mu-chloro)(2-propenyl)palladium) \| Bis(allyl(mu-chloro)palladium) \| Bis(eta3-allyl)dichlorodipalladium \| Palladium allyl chloride dimer \| MFCD00044874 \| Di-mu-chloro-bis(eta-allyl)palladium \| Q101
Specifications & Purity	Pd 58.2%
Storage Temp	Store at 2-8°C,Protected from light,Argon charged,Desiccated
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	Allylpalladium(II) chloride dimer is employed as catalyst in Heck reaction. It also participates as catalyst in the tandem nucleophilic allylation-alkoxyallylation reaction of the alkynylaldehydes with allyl chloride and allyltributylstannane. Allylpalladium(II) chloride dimer has been employed for the following studies: ● Synthesis of cationic palladium cataysts, used in the microwave-assisted Heck arylation. ● Synthesis of N-heterocyclic carbene-palladium-η3-allyl chloride complexes, which are efficient catalyst for the Suzuki-Miyaura cross-coupling of aryl bromides and activated aryl chlorides. ● Synthesis of 1,4-diallyl-1,2-dihydroisoquinolines. ● As catalyst for greener Buchwald-Hartwig coupling in TPGS-750-M. Application Precatalysts for Asymmetric and Cross-Coupling Catalysis Product class M-C, Homogeneous Catalysts, Allyl Ligands Reaction type Cross Coupling Reactions with Arenes, Amination, Allylic Alkylation, Buchwald-Hartwig Aminaton, Asymmetric Reactions, CH-Activation, Mizoroki Heck Coupling Reaction Chemical properties Chemical formula C6H10Cl2Pd2 Empirical formula [Pd(allyl)Cl]2 Molecular weight 365.89 Metal Pd Theoretical metal content 58 Physical state crystalline Color yellow

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic salts
  - Class Organic metal salts
    - Subclass Organic metal halides

Kingdom	Organic compounds
Superclass	Organic salts
Class	Organic metal salts
Subclass	Organic metal halides
Intermediate Tree Nodes	Not available
Direct Parent	Organic metal halides
Alternative Parents	Organic transition metal salts Unsaturated aliphatic hydrocarbons Olefins Hydrocarbon derivatives
Molecular Framework	Not available
Substituents	Organic metal halide - Organic transition metal salt - Unsaturated aliphatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon derivative - Olefin - Hydrocarbon - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as organic metal halides. These are organic compounds containing metals and halogens. Some are ionic while others are covalently bonded.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504753787
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504753787
IUPAC Name	chloropalladium(1+);prop-1-ene
INCHI	InChI=1S/2C3H5.2ClH.2Pd/c21-3-2;;;;/h23H,1-2H2;21H;;/q2-1;;;2*+2/p-2
InChIKey	PENAXHPKEVTBLF-UHFFFAOYSA-L
Smiles	[CH2-]C=C.[CH2-]C=C.Cl[Pd+].Cl[Pd+]
Isomeric SMILES	[CH2-]C=C.[CH2-]C=C.Cl[Pd+].Cl[Pd+]
WGK Germany	3
RTECS	RT3510000
PubChem CID	61538
Molecular Weight	365.89
Beilstein	4124623

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot Number	Certificate Type	Date	Item
D1912042	Certificate of Analysis	Nov 11, 2022	A101182
A2218026	Certificate of Analysis	Feb 14, 2022	A101182
A2218028	Certificate of Analysis	Feb 14, 2022	A101182
B2321035	Certificate of Analysis	Feb 14, 2022	A101182

Chemical and Physical Properties

Solubility	Insoluble in water; Soluble in Acetone,Benzene,Methanol,Chloroform
Sensitivity	Light Sensitive,Moisture Sensitive
Melt Point(°C)	120°C
Molecular Weight	365.900 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	365.823 Da
Monoisotopic Mass	363.823 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	14.400
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	4

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