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Structure

Bis(triphenylphosphine)palladium(II) Dichloride

CAS
13965-03-2
Catalog Number
ACM13965032
Category
Palladium series catalysts
Molecular Weight
701.904g/mol
Molecular Formula
C36H30Cl2P2Pd;

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Specification

Synonyms
TRANS-BIS-(TRIPHENYLPHOSPHINE)PALLADIUM DICHLORIDE; 13965-03-2; 28966-81-6; AC1L36TY; SC-01002; LS-192238; bis(triphenylphosphine) palladiuml(ii) dichloride; bis(triphenylphosphine) palladium (ii) chloride; FC0823; EINECS 237-744-2;
IUPAC Name
palladium(2+);triphenylphosphane;dichloride;
Canonical SMILES
C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Cl-].[Pd+2];
InChI
InChI=1S/2C18H15P.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-15H;2*1H;/q;;;;+2/p-2;
InChI Key
YNHIGQDRGKUECZ-UHFFFAOYSA-L;
Application
Precatalyst for the carbonylative cyclization of malonate derivatives.

Catalyst used in the double allylation of activated olefins.

Precatalyst for the three-component preparation of 3-arylidene- (or 3-alkenylidene) tetrahydrofurans.

Precatalyst for the homocoupling of terminal alkynes.

Precatalyst in the cross-coupling of alkynylsilanols and aryl halides.

Catalyst for direct Pd-catalyzed alkynylation of N-fused heterocycles.

Catalyst for a tandem Heck reaction/C-H functionalization.

Catalyst for direct arylation of tautomerizable heterocycles.
Storage
Store below +30°C.
Complexity
202
Covalently-Bonded Unit Count
5
EC Number
237-744-2
Exact Mass
700.023g/mol
H-Bond Acceptor
2
Heavy Atom Count
41
Monoisotopic Mass
700.023g/mol
Rotatable Bond Count
6
Topological Polar Surface Area
0A^2
What is the molecular formula of Bis(triphenylphosphine)palladium(II) Dichloride?

The molecular formula is C36H30Cl2P2Pd.

What is the molecular weight of Bis(triphenylphosphine)palladium(II) Dichloride?

The molecular weight is 701.9 g/mol.

What is the IUPAC name of Bis(triphenylphosphine)palladium(II) Dichloride?

The IUPAC name is dichloropalladium;triphenylphosphane.

What is the InChIKey of Bis(triphenylphosphine)palladium(II) Dichloride?

The InChIKey is YNHIGQDRGKUECZ-UHFFFAOYSA-L.

What is the canonical SMILES of Bis(triphenylphosphine)palladium(II) Dichloride?

The canonical SMILES is C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Pd]Cl.

What is the CAS number of Bis(triphenylphosphine)palladium(II) Dichloride?

The CAS number is 13965-03-2.

What is the hydrogen bond donor count of Bis(triphenylphosphine)palladium(II) Dichloride?

The hydrogen bond donor count is 0.

What is the hydrogen bond acceptor count of Bis(triphenylphosphine)palladium(II) Dichloride?

The hydrogen bond acceptor count is 0.

What is the rotatable bond count of Bis(triphenylphosphine)palladium(II) Dichloride?

The rotatable bond count is 6.

What is the topological polar surface area of Bis(triphenylphosphine)palladium(II) Dichloride?

The topological polar surface area is 0.

What are the synonyms of Bis(triphenylphosphine)palladium(II) Dichloride?

The synonyms are 13965-03-2, Dichlorobis(triphenylphosphine)palladium(II), Bis(triphenylphosphine)palladium(II) dichloride, and bis(triphenylphosphine)palladium(ii) chloride.

What are the component compounds of Bis(triphenylphosphine)palladium(II) Dichloride?

The component compounds are Palladium(II) chloride and Triphenylphosphine.

What is the InChI of Bis(triphenylphosphine)palladium(II) Dichloride?

The InChI is InChI=1S/2C18H15P.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-15H;2*1H;/q;;;;+2/p-2.

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