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5-(Dicyclohexylphosphino)-1',3',5'-triphenyl-[1,4']-bi-1H-pyrazole, min. 95% Cy-BippyPhos

5-(Dicyclohexylphosphino)-1',3',5'-triphenyl-[1,4']-bi-1H-pyrazole, min. 95% Cy-BippyPhos

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Molecular Formula:

C36H39N4P

Molecular Weight:

558.70

CAS Number:

1021176-69-1

Catalog Number:

1021176-69-1

Product Information

Molecular Formula:

C36H39N4P

Molecular Weight:

558.70

Description

5-(Dicyclohexylphosphino)-1',3',5'-triphenyl-[1,4']-bi-1H-pyrazole, min. 95% Cy-BippyPhos finds extensive utility in the biomedical sector. This compound, acting as a ligand in coordination chemistry, is indispensable for synthesizing a diverse array of organometallic complexes. With its distinctive and intricate structure, it exhibits exceptional metal atom binding capabilities, thus facilitating the creation of catalysts imperative for pharmaceutical and agrochemical production.

Synonyms

Cy-BippyPhos

IUPAC Name

dicyclohexyl-[2-(1,3,5-triphenylpyrazol-4-yl)pyrazol-3-yl]phosphane

Canonical SMILES

C1CCC(CC1)P(C2CCCCC2)C3=CC=NN3C4=C(N(N=C4C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C36H39N4P/c1-6-16-28(17-7-1)34-36(35(29-18-8-2-9-19-29)39(38-34)30-20-10-3-11-21-30)40-33(26-27-37-40)41(31-22-12-4-13-23-31)32-24-14-5-15-25-32/h1-3,6-11,16-21,26-27,31-32H,4-5,12-15,22-25H2

InChI Key

ZMENEJKATASVIH-UHFFFAOYSA-N

Melting Point

177-180 °C (lit.)

Flash Point

Not applicable

Purity

97%

Storage

2-8°C

Computed Properties

XLogP3

8.7

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

558.29123426 g/mol

Monoisotopic Mass

558.29123426 g/mol

Topological Polar Surface Area

35.6Å²

Heavy Atom Count

Formal Charge

Complexity

761

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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5-(Dicyclohexylphosphino)-1',3',5'-triphenyl-[1,4']-bi-1H-pyrazole, min. 95% Cy-BippyPhos

Product Information

Computed Properties

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