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Structure

Bis (tri-t-butylphosphine) palladium bromide (I), dimer

CAS
185812-86-6
Catalog Number
ACM185812866
Category
Palladium series catalysts
Molecular Weight
388.646g/mol
Molecular Formula
C12H27BrPPd-;

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Specification

Synonyms
MFCD04114019; 185812-86-6; CTK8C5468; palladium(I) tri-tertbutylphosphine bromide; PUBCHEM_71317307; Palladium(I) tri-tert-butylphosphine bromide;
IUPAC Name
palladium;tritert-butylphosphane;bromide;
Canonical SMILES
CC(C)(C)P(C(C)(C)C)C(C)(C)C.[Br-].[Pd];
InChI
InChI=1S/C12H27P.BrH.Pd/c1-10(2,3)13(11(4,5)6)12(7,8)9;;/h1-9H3;1H;/p-1;
InChI Key
WIADNXKBAGKNOT-UHFFFAOYSA-M;
Application
Palladium catalyst for rapid room temperature alkylation of unactivated hindered aryl bromides with arylboronic acids.

Aryl bromide - silyl ketene acetal coupling.

Catalyst for intermolecular α-arylation of zinc amide enolates.

Catalyst for α-vinylation of carbonyl compounds.

Catalyst for thiol coupling of heteroaromatic aryl bromides.
Complexity
128
Covalently-Bonded Unit Count
3
Exact Mass
387.007g/mol
Formal Charge
-1
H-Bond Acceptor
1
Heavy Atom Count
15
Monoisotopic Mass
387.007g/mol
Rotatable Bond Count
3
Topological Polar Surface Area
0A^2
December 15, 2022


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What is IUPAC Name of Bis (tri-t-butylphosphine) palladium bromide?

palladium;tritert-butylphosphane;bromide

What is InChI of Bis (tri-t-butylphosphine) palladium bromide?

InChI=1S/C12H27P.BrH.Pd/c1-10(2,3)13(11(4,5)6)12(7,8)9;;/h1-9H3;1H;/p-1

What is InChIKey of Bis (tri-t-butylphosphine) palladium bromide?

WIADNXKBAGKNOT-UHFFFAOYSA-M

What is Molecular Formula of Bis (tri-t-butylphosphine) palladium bromide?

C12H27BrPPd-

What is Canonical SMILES of Bis (tri-t-butylphosphine) palladium bromide?

CC(C)(C)P(C(C)(C)C)C(C)(C)C.[Br-].[Pd]

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