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Bis(tri-tert-butylphosphine)palladium(0) - Pd 20.8%, high purity , CAS No.53199-31-8

COA

Grade & Purity:

Pd 20.8%

Cas Number: 53199-31-8
Molecular Weight: 511.05
MDL number: MFCD03094580
PubChem CID: 2734558

In stock

Item Number

B110179

Grouped product items
SKU	Size	Availability	Price
B110179-250mg	250mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$67.90
B110179-1g	1g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$210.90
B110179-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$949.90

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Element classified compounds (2014) Palladium catalyst (83)

Basic Description

Synonyms	Fu catalyst \| Pd(t-Bu3P)2 \| BIS(TRI-T-BUTYLPHOSPHINE)PALLADIUM \| Palladium, bis[tris(1,1-dimethylethyl)phosphine]- \| PB42990 \| palladium;tritert-butylphosphane \| DTXSID80370359 \| Bis[tris(tert-butyl)phosphine]palladium \| STR08646 \| MFCD03094580 \| SC10403
Specifications & Purity	Pd 20.8%
Storage Temp	Store at -20°C,Argon charged
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	Product class M-P, Homogeneous Catalysts, M-C, Alkyl Ligands, Monodentate Ligands Reaction type Cross Coupling Reactions with Arenes, Amination, Buchwald-Hartwig Aminaton, Carbonylation, Mizoroki Heck Coupling Reaction, Negishi Coupling Reaction, Stille Reaction, Suzuki-Miyaura Coupling Reaction Chemical properties Chemical formula C24H54P2Pd Empirical formula [Pd(P(tBu3))2] Molecular weight 511.06 Metal Pd Theoretical metal content 21 Physical state crystalline Color white Applications & references Diastereoselctive synthesis of isochromans using a Palladium catalyzed carboiodination. Reference: Org. Lett. 2012, 14, 4806. (DOI: 10.1021/ol302111y) High yielding Palladium catalyzed C-H arylation of electron-enriched heteroarenes with aryl halides. Reference: J. Org. Chem. 2010, 75, 6998. (DOI: 10.1021/jo101433g) Arylation of hydrosiloxanes for the synthesis of symmetrical and unsymmetrical siloxanes. They are interesting substrates for the usage as liquid crystals, starting materials for cross coupling reactions and biologically active compounds. Reference: Chem. Comm. 2013, 49, 11275. (DOI: 10.1039/c3cc46294c)

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organophosphorus compounds
  - Class Organic phosphines and derivatives

Kingdom	Organic compounds
Superclass	Organophosphorus compounds
Class	Organic phosphines and derivatives
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Organic phosphines and derivatives
Alternative Parents	Organic transition metal salts Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework	Not available
Substituents	Phosphine - Organic transition metal salt - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as organic phosphines and derivatives. These are organic compounds containing a phosphine derivative, with the general formula B1P(R2)R3 (R1-R3=alkyl, aryl).
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

IUPAC Name	palladium;tritert-butylphosphane
INCHI	InChI=1S/2C12H27P.Pd/c21-10(2,3)13(11(4,5)6)12(7,8)9;/h21-9H3;
InChIKey	MXQOYLRVSVOCQT-UHFFFAOYSA-N
Smiles	CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)P(C(C)(C)C)C(C)(C)C.[Pd]
Isomeric SMILES	CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)P(C(C)(C)C)C(C)(C)C.[Pd]
WGK Germany	3
Molecular Weight	511.05
Reaxy-Rn	14300595
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14300595&ln=

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.

3 results found

Lot Number	Certificate Type	Date	Item
I2113010	Certificate of Analysis	Jun 16, 2023	B110179
I2113009	Certificate of Analysis	Jun 16, 2023	B110179
G1901008	Certificate of Analysis	Feb 03, 2023	B110179

Chemical and Physical Properties

Solubility	Soluble in toluene benzene, slight soluble in chloroform and acetone. Decomposes in water.
Sensitivity	air & heat & light & moisture sensitive
Melt Point(°C)	>300°C
Molecular Weight	511.100 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	6
Exact Mass	510.274 Da
Monoisotopic Mass	510.274 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	128.000
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	3

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