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N-[2-(di-1-adamantylphosphino)phenyl]morpholine, 98% Mor-DalPhos

N-[2-(di-1-adamantylphosphino)phenyl]morpholine, 98% Mor-DalPhos

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Molecular Formula:

C30H42NOP

Molecular Weight:

463.63

CAS Number:

1237588-12-3

Catalog Number:

1237588-12-3

Product Information

Molecular Formula:

C30H42NOP

Molecular Weight:

463.63

Description

MorDalphos is an electronically rich, sterically hindered P,N-based ancillary ligand developed by the Stradiotto group that can be used in the Buchwald-Hartwig Amination reaction, alkyne hydroamination and monoarylation of compounds such as ammonia, hydrazine, and acetone.

Synonyms

bis(1-adamantyl)-(2-morpholin-4-ylphenyl)phosphane; Mor-DalPhos; 1237588-12-3; Di(1-adamantyl)-2-morpholinophenylphosphine; N-[2-(DI-1-ADAMANTYLPHOSPHINO)PHENYL]MORPHOLINE; SCHEMBL8877346

IUPAC Name

bis(1-adamantyl)-(2-morpholin-4-ylphenyl)phosphane

Canonical SMILES

C1COCCN1C2=CC=CC=C2P(C34CC5CC(C3)CC(C5)C4)C67CC8CC(C6)CC(C8)C7

InChI

InChI=1S/C30H42NOP/c1-2-4-28(27(3-1)31-5-7-32-8-6-31)33(29-15-21-9-22(16-29)11-23(10-21)17-29)30-18-24-12-25(19-30)14-26(13-24)20-30/h1-4,21-26H,5-20H2

InChI Key

CCBRRSUORFMQCZ-UHFFFAOYSA-N

Melting Point

219-224 °C

Flash Point

Not applicable

Purity

95%

Storage

2-8°C

Computed Properties

XLogP3

6.6

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

463.30040196 g/mol

Monoisotopic Mass

463.30040196 g/mol

Topological Polar Surface Area

12.5Å²

Heavy Atom Count

Formal Charge

Complexity

632

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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N-[2-(di-1-adamantylphosphino)phenyl]morpholine, 98% Mor-DalPhos

Product Information

Computed Properties

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