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(2Z,6Z)-N'2,N'6-Dicyanopyridine-2,6-bis(carboximidamide)

(2Z,6Z)-N'2,N'6-Dicyanopyridine-2,6-bis(carboximidamide)

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Molecular Formula:

C9H7N7

Molecular Weight:

213.20

CAS Number:

2105938-35-8

Catalog Number:

2105938-35-8

Product Information

Molecular Formula:

C9H7N7

Molecular Weight:

213.20

Description

This pyridyl carboxamidine ligand has been demonstrated by Daniel Weix's lab to enable nickel-catalyzed cross-coupling of diverse basic nitrogen heterocycles with primary and secondary alkyl halides.

Synonyms

Weix 2-pyridyl-N-cyanocarboxamidine ligand for nickel catalysis

IUPAC Name

2-N',6-N'-dicyanopyridine-2,6-dicarboximidamide

Canonical SMILES

C1=CC(=NC(=C1)C(=NC#N)N)C(=NC#N)N

InChI

InChI=1S/C9H7N7/c10-4-14-8(12)6-2-1-3-7(16-6)9(13)15-5-11/h1-3H,(H2,12,14)(H2,13,15)

InChI Key

NFCPGRIKBAMXHQ-UHFFFAOYSA-N

Melting Point

>300 °C

Flash Point

Not applicable

Computed Properties

XLogP3

-0.1

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

213.07629325 g/mol

Monoisotopic Mass

213.07629325 g/mol

Topological Polar Surface Area

137Å²

Heavy Atom Count

Formal Charge

Complexity

366

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

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Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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(2Z,6Z)-N'2,N'6-Dicyanopyridine-2,6-bis(carboximidamide)

Product Information

Computed Properties

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