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914096

1,3-Bis(2,6-di(3-pentyl)phenyl)imidazolium chloride

Name: 1,3-Bis(2,6-di(3-pentyl)phenyl)imidazolium chloride
Brand: ALDRICH

≥95%, powder

Synonym(s):

IPent-HCl

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About This Item

Empirical Formula (Hill Notation):

C₃₅H₅₃ClN₂

CAS Number:

1157867-61-2

Molecular Weight:

537.26

MDL number:

MFCD27978383

UNSPSC Code:

12352005

NACRES:

NA.22

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Properties

Product Name

1,3-Bis(2,6-di(3-pentyl)phenyl)imidazolium chloride, ≥95%

Quality Level

100

assay

≥95%

form

powder

mp

362-364 °C

SMILES string

[Cl-].[n+]2(c[n](cc2)c3c(cccc3C(CC)CC)C(CC)CC)c1c(cccc1C(CC)CC)C(CC)CC

InChI

1S/C35H53N2.ClH/c1-9-26(10-2)30-19-17-20-31(27(11-3)12-4)34(30)36-23-24-37(25-36)35-32(28(13-5)14-6)21-18-22-33(35)29(15-7)16-8;/h17-29H,9-16H2,1-8H3;1H/q+1;/p-1

InChI key

ODQOSTRWDUNLQB-UHFFFAOYSA-M

Description

Application

1,3-Bis(2,6-di(3-pentyl)phenyl)imidazolium chloride is an NHC ligand used in a variety of Pd catalyzed cross-coupling reactions.

Other Notes

Pd-PEPPSI-IPent: an active, sterically demanding cross-coupling catalyst and its application in the synthesis of tetra-ortho-substituted biaryls

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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Pd-PEPPSI-IPent: an active, sterically demanding cross-coupling catalyst and its application in the synthesis of tetra-ortho-substituted biaryls.

Michael G Organ et al.

Angewandte Chemie (International ed. in English), 48(13), 2383-2387 (2009-02-20)

Incredible Bulk: A series of N-heterocyclic carbene catalysts (see picture) were prepared and evaluated in the Suzuki-Miyaura reaction. A variety of sterically encumbered tetra-ortho-substituted biaryl products were formed from unreactive aryl chlorides using the isopentyl-substituted catalyst at temperatures ranging from

Global Trade Item Number

SKU	GTIN
914096-2G	04061842052684
914096-500MG	04061842052691