Dicyclohexyl(2,4,6-triisopropylphenyl)phosphine

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Molecular Formula:

C27H45P

Molecular Weight:

400.62

CAS Number:

303111-96-8

Catalog Number:

303111-96-8

Product Information

Molecular Formula:

C27H45P

Molecular Weight:

400.62

Description

Catalyst for oxidation of alcohols and hydrodechlorination of chloroarenes.

Synonyms

dicyclohexyl-[2,4,6-tri(propan-2-yl)phenyl]phosphine; dicyclohexyl-[2,4,6-tri(propan-2-yl)phenyl]phosphane

IUPAC Name

dicyclohexyl-[2,4,6-tri(propan-2-yl)phenyl]phosphane

Canonical SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)P(C2CCCCC2)C3CCCCC3)C(C)C

InChI

InChI=1S/C27H45P/c1-19(2)22-17-25(20(3)4)27(26(18-22)21(5)6)28(23-13-9-7-10-14-23)24-15-11-8-12-16-24/h17-21,23-24H,7-16H2,1-6H3

InChI Key

DTSPXGRQYHLKLO-UHFFFAOYSA-N

Boiling Point

479.454 °C at 760 mmHg

Melting Point

138-140 °C

Purity

97 %

Appearance

Solid

LogP

8.82940

Computed Properties

XLogP3

8.5

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

400.32588843 g/mol

Monoisotopic Mass

400.32588843 g/mol

Topological Polar Surface Area

0Å²

Heavy Atom Count

Formal Charge

Complexity

405

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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Volume _(start)

Concentration _(final)

Volume _(final)

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Dicyclohexyl(2,4,6-triisopropylphenyl)phosphine

Product Information

Computed Properties

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