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2-(Dicyclohexylphosphino)-N,N-bis(1-methylethyl)-1H-indole-1-carboxamide, min. 98% Amidole-Phos

2-(Dicyclohexylphosphino)-N,N-bis(1-methylethyl)-1H-indole-1-carboxamide, min. 98% Amidole-Phos

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Molecular Formula:

C27H41N2OP

Molecular Weight:

440.60

CAS Number:

1067175-36-3

Catalog Number:

1067175-36-3

Product Information

Molecular Formula:

C27H41N2OP

Molecular Weight:

440.60

Description

Effective ligand for cross-coupling of aryl chlorides

Synonyms

2-Dicyclohexylphosphanyl-N,N-di(propan-2-yl)indole-1-carboxamide; 2-(Dicyclohexylphosphino)-N,N-diisopropyl-1H-indole-1-carboxamide, 97%

IUPAC Name

2-dicyclohexylphosphanyl-N,N-di(propan-2-yl)indole-1-carboxamide

Canonical SMILES

CC(C)N(C(C)C)C(=O)N1C2=CC=CC=C2C=C1P(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C27H41N2OP/c1-20(2)28(21(3)4)27(30)29-25-18-12-11-13-22(25)19-26(29)31(23-14-7-5-8-15-23)24-16-9-6-10-17-24/h11-13,18-21,23-24H,5-10,14-17H2,1-4H3

InChI Key

FDXSDIWDTPDIQJ-UHFFFAOYSA-N

Melting Point

191-196 °C

Purity

95%

Computed Properties

XLogP3

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

440.29565093 g/mol

Monoisotopic Mass

440.29565093 g/mol

Topological Polar Surface Area

25.2Å²

Heavy Atom Count

Formal Charge

Complexity

556

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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2-(Dicyclohexylphosphino)-N,N-bis(1-methylethyl)-1H-indole-1-carboxamide, min. 98% Amidole-Phos

Product Information

Computed Properties

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