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2-(1,1-Dimethylpropyl)-6-(diphenylphosphino)pyridine

2-(1,1-Dimethylpropyl)-6-(diphenylphosphino)pyridine

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Molecular Formula:

C22H24NP

Molecular Weight:

333.41

CAS Number:

947315-18-6

Catalog Number:

947315-18-6

Product Information

Molecular Formula:

C22H24NP

Molecular Weight:

333.41

Description

Catalyst for:• Regioselective synthesis of oligo-1,4-diols• Anti-Markovnikov hydration

Synonyms

2-tert-Amyl-6-(diphenylphosphino)pyridine, ALPYPHOS

IUPAC Name

[6-(2-methylbutan-2-yl)pyridin-2-yl]-diphenylphosphane

Canonical SMILES

CCC(C)(C)C1=NC(=CC=C1)P(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24NP/c1-4-22(2,3)20-16-11-17-21(23-20)24(18-12-7-5-8-13-18)19-14-9-6-10-15-19/h5-17H,4H2,1-3H3

InChI Key

ZEQMNGUCEYRQRF-UHFFFAOYSA-N

Melting Point

78-82 °C

Purity

≥98.0% (HPLC)

Storage

2-8°C

Safety Information

Hazards

H413

Computed Properties

XLogP3

5.9

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

333.164636767 g/mol

Monoisotopic Mass

333.164636767 g/mol

Topological Polar Surface Area

12.9Å²

Heavy Atom Count

Formal Charge

Complexity

350

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-(1,1-Dimethylpropyl)-6-(diphenylphosphino)pyridine

Product Information

Safety Information

Computed Properties

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