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Merck
CN

763101

Sigma-Aldrich

(Acetonitrile)[(2-di-tert-butylphosphino-3,4,5,6-tetramethyl)-2′,4′,6′-triisopropylbiphenyl]gold(I) hexafluoroantimonate

Synonym(s):

Me4-tert-butyl XPhos-AuMeCN SbF6

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About This Item

Empirical Formula (Hill Notation):
C35H56AuF6NPSb
CAS Number:
Molecular Weight:
954.52
MDL number:
UNSPSC Code:
12352300
PubChem Substance ID:
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form

solid

reaction suitability

core: gold
reagent type: catalyst

impurities

<5% Chloroform

mp

200-217 °C (decomposition)

SMILES string

CC#[N+][Au].F[Sb-](F)(F)(F)(F)F.CC(C)c1cc(C(C)C)c(c(c1)C(C)C)-c2c(C)c(C)c(C)c(C)c2P(C(C)(C)C)C(C)(C)C

InChI

1S/C33H53P.C2H3N.Au.6FH.Sb/c1-19(2)26-17-27(20(3)4)30(28(18-26)21(5)6)29-24(9)22(7)23(8)25(10)31(29)34(32(11,12)13)33(14,15)16;1-2-3;;;;;;;;/h17-21H,1-16H3;1H3;;6*1H;/q;;+1;;;;;;;+5/p-6

InChI key

RYAHVCSWEWNLIW-UHFFFAOYSA-H

Application

Effective gold catalyst for selective 6-endo dig carbocyclizations.

Pictograms

Health hazard

Signal Word

Warning

Hazard Statements

Precautionary Statements

Hazard Classifications

Carc. 2 - Repr. 2 - STOT RE 2

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Regulatory Information

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Francis Barabé et al.
Organic letters, 13(20), 5580-5583 (2011-09-16)
A gold-catalyzed synthesis of fused carbocycles via a regioselective 6-endo dig process is reported. The selectivity can be modulated by the steric and electronic properties of gold(I) complexes. The ligands can influence the pathway selectivity for the first bond formation

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