Bis[(dicyclohexyl)(4-dimethylaminophenyl)phosphine] palladium(II) chloride

Product Information

Molecular Formula:
(CH3)2NC6H4P(C6H11)2PdCl2P(C6H4N(CH3)2)(C6H11)2
Molecular Weight:
812.22
Description
Bis[(dicyclohexyl)(4-dimethylaminophenyl)phosphine] palladium(II) chloride is a powerful catalyst widely used in the biomedical industry. It plays a crucial role in various organic transformations, including Suzuki-Miyaura cross-coupling reactions. This product is essential for the synthesis of pharmaceutical drugs, such as antineoplastic agents and antiviral compounds, and contributes to the treatment of cancer, viral infections, and other diseases.
Synonyms
(A-caPhos)2 PdCl2
IUPAC Name
dichloropalladium4-dicyclohexylphosphanyl-N,N-dimethylaniline
Canonical SMILES
CN(C)C1=CC=C(C=C1)P(C2CCCCC2)C3CCCCC3.CN(C)C1=CC=C(C=C1)P(C2CCCCC2)C3CCCCC3.Cl[Pd]Cl
InChI
InChI=1S/2C20H32NP.2ClH.Pd/c2*1-21(2)17-13-15-20(16-14-17)22(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h2*13-16,18-19H,3-12H2,1-2H32*1H/q+2/p-2
InChI Key
FASFJCMBLNNDNL-UHFFFAOYSA-L
Flash Point
Not applicable
Purity
96%

Safety Information

Hazards
H315 - H319 - H335
Precautionary Statement
P302 + P352 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
8
Exact Mass
810.29566 g/mol
Monoisotopic Mass
810.29566 g/mol
Topological Polar Surface Area
6.5Ų
Heavy Atom Count
47
Formal Charge
0
Complexity
294
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
3
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
WO-2021062035-A1 Luminescent materials and methods thereof 2019-09-27
KR-20200131241-A 2 kinds of 4-v[(2S)-2-v4-[5-chloro-2-(1H-1,2,3-triazol-1-yl)phenyl]-5-methoxy-2-oxo Method for producing pyridin-1(2H)-yl}butanoyl]amino}-2-fluorobenzamide derivative 2018-03-15
BR-112020018562-A2 PREPARATIVE PROCESS 2018-03-15
US-2021017152-A1 Preparative process 2018-03-15
EP-3889147-A1 4-({(2s)-2-[4-{5-chloro-2-[4-(trifluoromethyl)-1h-1,2,3-triazol-1-yl]phenyl}-5-methoxy-2-oxopyridin-1(2h)-yl]butanoyl}-amino)-2-fluorobenzamide acetone and its use 2018-03-15
JP-2021517573-A Two 4-{[(2S) -2-{4- [5-chloro-2- (1H-1,2,3-triazole-1-yl) phenyl] -5-methoxy-2-oxopyridine-1 Method for preparing (2H) -yl} butanoyl] amino} -2-fluorobenzamide derivative 2018-03-15
TW-201946915-A Method and intermediate for preparing therapeutic compound 2018-02-16
US-10696657-B2 Methods and intermediates for preparing therapeutic compounds 2018-02-16
US-2019300505-A1 Methods and intermediates for preparing therapeutic compounds 2018-02-16
WO-2019161280-A1 Methods and intermediates for preparing a therapeutic compound useful in the treatment of retroviridae viral infection 2018-02-16
The molarity calculator equation

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

The dilution calculator equation

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

This equation is commonly abbreviated as: C1V1 = C2V2

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