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Merck
CN

76902

1-(3-Cyanopropyl)-3-methylimidazolium dicyanamide

≥98.5% (HPLC/T)

Synonym(s):

1-Methyl-3-(3-cyanopropyl)imidazolium dicyanamide

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About This Item

Empirical Formula (Hill Notation):
C10H12N6
CAS Number:
Molecular Weight:
216.24
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Assay

≥98.5% (HPLC/T)

form

liquid

impurities

≤0.5% water

refractive index

n20/D 1.524

SMILES string

N#C[N-]C#N.C[n+]1ccn(CCCC#N)c1

InChI

1S/C8H12N3.C2N3/c1-10-6-7-11(8-10)5-3-2-4-9;3-1-5-2-4/h6-8H,2-3,5H2,1H3;/q+1;-1

InChI key

GPLYXNDEHINOHN-UHFFFAOYSA-N

Application

Nitrile-functionalized ionic liquid showing superior characteristics in Suzuki and Stille coupling reactions.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

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

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Dongbin Zhao et al.
Journal of the American Chemical Society, 126(48), 15876-15882 (2004-12-02)
A series of relatively low-cost ionic liquids, based on the N-butyronitrile pyridinium cation [C(3)CNpy](+), designed to improve catalyst retention, have been prepared and evaluated in Suzuki and Stille coupling reactions. Depending on the nature of the anion, these salts react

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