ditert-butyl(cyclopentyl)phosphane; ditert-butyl(cyclopentyl)phosphane; dichloropalladium; iron

Basic Information

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CAS Number

95408-45-0

Molecular Formula

C26H44Cl2FeP2Pd

Molecular Weight

651.76 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Insecticides

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

203-208 °C

Solubility

Soluble in dichloromethane and chloroform. Partially soluble in acetone, alcohols, tertrahydrofuran and dioxane.

SMILES

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CC(C)(C)[PH+](C1=CC=C[CH-]1)C(C)(C)C.CC(C)(C)[PH+](C1=CC=C[CH-]1)C(C)(C)C.Cl[Pd]Cl.[Fe+2]

InChI

InChI=1S/2C13H27P.2ClH.Fe.Pd/c2*1-12(2,3)14(13(4,5)6)11-9-7-8-10-11;;;;/h2*11H,7-10H2,1-6H3;2*1H;;/q;;;;;+2/p-2

InChIKey

UVNSVVWPEKSJSV-UHFFFAOYSA-L

LogP

11.087599999999986

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

418

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

LS-0004
1,1'-Bis(di-tert-butylphosphino)-ferrocene-palladium dichloride
95408-45-0
AKOS024262724
1,1'-Bis (di-t-butylphosphino)ferrocene palladium dichloride,
Dichloro[1,1'-bis(di-t-butylphosphino)ferrocene]palladium(II),98%
1,1'-Bis(di-tert-butylphosphino)ferrocene-palladium dichloride
1,1'-Bis(di-tert-butylphosphino)ferrocene palladium dichloride
[1,1'-Bis(di-tert-butylphosphino)ferrocene]palladium(II) Dichloride
1,1′-Bis-(di-tert.-butylphosphino-)ferrocen-palladiumdichlorid
PdCl2(dtbpf)
[1,1'-Bis(di-tert-butylphosphino)ferrocene]dichloropalladium(II)
Dichloro[1,1'-bis(di-tert-butylphosphino)ferrocene]palladium(II)
1,1'-Bis(di-t-butylphosphino)ferrocene palladium(II)dichloride
Palladium, [1,1'-bis[bis(1,1-dimethylethyl)phosphino]ferrocene-P,P']dichloro-
(SP-4-2)-[1,1'-Bis[bis(1,1-dimethylethyl)phosphino-κP]ferrocene]dichloropalladium
Ferrocene, 1,1'-bis[bis(1,1-dimethylethyl)phosphino]-, palladium complex
Dichloro(1,1'-bis(di-tert-butylphosphino)ferrocene)palladium
[1,1'-Bis(di-tert-butylphosphino)ferrocene]palladium dichloride
1,1'-Bis(di-tert-butylphosphino)ferrocenedichloropalladium(II)

MDL Number

MFCD08064219

Customs Code

28439000

FAQ

What is ditert-butyl(cyclopentyl)phosphane (CAS: 95408-45-0)?

Ditert-butyl(cyclopentyl)phosphane (CAS: 95408-45-0) is a colorless, flammable liquid with a phosphorus and cyclopentyl odor. It has a molecular formula of C15H30P and boiling point of 126-127°C. This compound is mainly used in organophosphorus chemistry and as a ligand in catalysis.

What are the main uses of ditert-butyl(cyclopentyl)phosphane (CAS: 95408-45-0)?

Ditert-butyl(cyclopentyl)phosphane (CAS: 95408-45-0) is widely used as a ligand in catalysis, particularly in palladium-catalyzed cross-coupling reactions. It also serves as a precursor in organic synthesis and as a reagent in various chemical reactions.

Is ditert-butyl(cyclopentyl)phosphane (CAS: 95408-45-0) safe?

Ditert-butyl(cyclopentyl)phosphane (CAS: 95408-45-0) is flammable and may be toxic if inhaled or ingested. Handling should be done in a well-ventilated area with appropriate respiratory protection. It is important to follow safety data sheet (SDS) guidelines and adhere to local safety standards. Personal protective equipment (PPE) such as gloves and safety goggles should be used.

How should ditert-butyl(cyclopentyl)phosphane (CAS: 95408-45-0) be stored?

Ditert-butyl(cyclopentyl)phosphane (CAS: 95408-45-0) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed, amber glass container to protect it from light and moisture. Store it at room temperature or below to ensure stability and prevent evaporation.