tBuBrettPhos Pd G6 Br

Name: tBuBrettPhos Pd G6 Br
Brand: BOC Sciences
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Molecular Formula:

C38H53BrF3O2PPd

Molecular Weight:

816.12

CAS Number:

2691807-28-8

Catalog Number:

BPM-501300

Product Information

Molecular Formula

C38H53BrF3O2PPd

Molecular Weight

816.12

Description

tBuBrettPhos Pd G6 Br is a well-defined Buchwald sixth-generation palladacycle precatalyst featuring a tBuBrettPhos ligand and a 4-(trifluoromethyl)phenyl palladium(II) core with a bromide counterion. It is a powerful precatalyst for classic cross-coupling reactions such as Suzuki-Miyaura, Buchwald-Hartwig amination, and C-N bond formation. The compound is bench-stable and soluble in most organic solvents. This precatalyst offers excellent functional group tolerance and high catalytic activity, making it a valuable tool in pharmaceutical synthesis and organic chemistry research.

Synonyms

Palladium, bromo[[3,6-dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl]bis(1,1-dimethylethyl)phosphine-κP][4-(trifluoromethyl)phenyl]-; Bromo[[3,6-dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl]bis(1,1-dimethylethyl)phosphine-κP][4-(trifluoromethyl)phenyl]palladium; Bis(2-methyl-2-propanyl)(2',4',6'-triisopropyl-3,6-dimethoxy-2-biphenylyl)phosphine bromo[4-(trifluoromethyl)phenyl]palladium (1:1); tBuBrettPhos OAC precatalyst Br

IUPAC Name

ditert-butyl-[3,6-dimethoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane;palladium(2+);5-(trifluoromethyl)cyclohexa-1,2,4-triene;bromide

SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)C2=C(C=CC(=C2P(C(C)(C)C)C(C)(C)C)OC)OC)C(C)C.C1=CC(=CC=[C-]1)C(F)(F)F.Br[Pd+]

InChI

InChI=1S/C31H49O2P.C7H4F3.BrH.Pd/c1-19(2)22-17-23(20(3)4)27(24(18-22)21(5)6)28-25(32-13)15-16-26(33-14)29(28)34(30(7,8)9)31(10,11)12;8-7(9,10)6-4-2-1-3-5-6;;/h15-21H,1-14H3;2-5H;1H;/q;-1;;+2/p-1

InChI Key

LPFKPCQJLGFXPK-UHFFFAOYSA-M

Purity

98%

Appearance

Light yellow powder

Storage

Store at RT, under inert atmosphere

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tBuBrettPhos Pd G6 Br

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