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Merck
CN

667412

Pentamethylcyclopentadienyltris (acetonitrile)ruthenium(II) hexafluorophosphate

solid

Synonym(s):

[RuCp*(MeCN)3]PF6

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About This Item

Empirical Formula (Hill Notation):
C16H24N3PRuF6
CAS Number:
99604-67-8
Molecular Weight:
504.42
UNSPSC Code:
12161600
PubChem Substance ID:
24884913
NACRES:
NA.22
MDL number:
MFCD08457650

Key Documents

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Product Name

Pentamethylcyclopentadienyltris (acetonitrile)ruthenium(II) hexafluorophosphate,

SMILES string

[Ru+].CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.CC1C(C)=C(C)C(C)=C1C

InChI key

IYEMDYLFXFMECZ-UHFFFAOYSA-N

InChI

1S/C10H16.3C2H3N.F6P.Ru/c1-6-7(2)9(4)10(5)8(6)3;3*1-2-3;1-7(2,3,4,5)6;/h6H,1-5H3;3*1H3;;/q;;;;-1;+1

form

solid

reaction suitability

core: ruthenium
reagent type: catalyst

storage temp.

2-8°C

Quality Level

100

Related Categories

Application

Hydrosilylation Catalysts
A versatile catalyst for hydrosilylation of alkynes providing α-vinylsilanes.
Reagent use as catalyst precursors for carbon-carbon or carbon-heteroatom bond forming reactions.

General description

Pentamethylcyclopentadienyltris (acetonitrile)ruthenium(II) hexafluorophosphate is an organoruthenium compound. It is used as a homogeneous catalyst in organic synthesis. It enables the hydrosilylation of alkynes, cyclotrimerization of alkynes, cycloaddition reactions, and carbon-carbon or carbon-heteroatom bond-forming reactions.

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
MKCQ2935
MKCP9297
MKCP6392
MKCN9853
MKCN7825

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Markovnikov alkyne hydrosilylation catalyzed by ruthenium complexes.
B M Trost et al.
Journal of the American Chemical Society, 123(50), 12726-12727 (2001-12-14)
Barry M Trost et al.
Journal of the American Chemical Society, 127(50), 17644-17655 (2005-12-15)
The complex [Cp*Ru(MeCN)3]PF6 is shown to catalyze the hydrosilylation of a wide range of alkynes. Terminal alkynes afford access to alpha-vinylsilane products with good regioselectivity. Deuterium labeling studies indicate a clean trans addition process is at work. The same complex

Articles

Hydrosilylation Catalyst

Trost group's protocol yields α-vinylsilanes from terminal acetylenes using [Cp*Ru(MeCN)3]PF6 catalyst and others for hydrosilylation.

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