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1-Methyl-2-(2-diisopropylphosphinophenyl)-1H-benzoimidazole

1-Methyl-2-(2-diisopropylphosphinophenyl)-1H-benzoimidazole

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Molecular Formula:

C20H25N2P

Molecular Weight:

324.40

CAS Number:

1357398-61-8

Catalog Number:

1357398-61-8

Product Information

Molecular Formula:

C20H25N2P

Molecular Weight:

324.40

Description

Phosphine ligand for Suzuki coupling of aryl mesylates.

Synonyms

2-(2-(Diisopropylphosphanyl)phenyl)-1-methyl-1H-benzo[d]imidazole; 1-Methyl-2-[2-(diisopropylphosphino)phenyl]-1H-benzoimidazole; 1-Methyl-2-(2-diisopropylphosphinophenyl)-1H-benzoimidazole, 97%

IUPAC Name

[2-(1-methylbenzimidazol-2-yl)phenyl]-di(propan-2-yl)phosphane

Canonical SMILES

CC(C)P(C1=CC=CC=C1C2=NC3=CC=CC=C3N2C)C(C)C

InChI

InChI=1S/C20H25N2P/c1-14(2)23(15(3)4)19-13-9-6-10-16(19)20-21-17-11-7-8-12-18(17)22(20)5/h6-15H,1-5H3

InChI Key

RGYYYYMIZGKBRJ-UHFFFAOYSA-N

Melting Point

147-152 °C

Flash Point

Not applicable

Purity

97%

Computed Properties

XLogP3

4.3

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

324.175535804 g/mol

Monoisotopic Mass

324.175535804 g/mol

Topological Polar Surface Area

17.8Å²

Heavy Atom Count

Formal Charge

Complexity

376

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

The molarity calculator equation

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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1-Methyl-2-(2-diisopropylphosphinophenyl)-1H-benzoimidazole

Product Information

Computed Properties

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