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2-(Di-tert-butylphosphino)-1-phenylindole

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2-(Di-tert-butylphosphino)-1-phenylindole Basic information

Product Name:
2-(Di-tert-butylphosphino)-1-phenylindole
Synonyms:
  • 2-(Di-tert-butylphosphino)-1-phenylindole
  • 2-(Di-tert-butylphosphino)-1-phenylindole 96%
  • 98% [cataCXiuM PIntB]
  • cataCXium(R) PIntB
  • 2-(di-tert-butylphosphino)-1-phenyl-1H-indole
  • N-Phenyl-2-(di-tert-butylphosphino)indole
  • N-Phenylindol-2-yl-di-tert-butylphosphine
  • N-Phenyl-2-(di-t-butylphosphino)indol,98%
CAS:
740815-37-6
MF:
C22H28NP
MW:
337.44
Product Categories:
  • Achiral Phosphine
  • Aryl Phosphine
Mol File:
740815-37-6.mol
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2-(Di-tert-butylphosphino)-1-phenylindole Chemical Properties

Melting point:
90-92℃ (methanol )
Boiling point:
455.4±27.0 °C(Predicted)
storage temp. 
Refrigerator, under inert atmosphere
solubility 
Acetonitrile (Slightly), Benzene (Slightly), Chloroform (Slightly)
form 
Powder
color 
white to yellow
Sensitive 
air sensitive
BRN 
9924511
InChI
1S/C22H28NP/c1-21(2,3)24(22(4,5)6)20-16-17-12-10-11-15-19(17)23(20)18-13-8-7-9-14-18/h7-16H,1-6H3
InChIKey
HDZRDZCQFYUOHE-UHFFFAOYSA-N
SMILES
CC(C)(C)P(c1cc2ccccc2n1-c3ccccc3)C(C)(C)C
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Safety Information

WGK Germany 
3
HS Code 
29339900
Storage Class
11 - Combustible Solids
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2-(Di-tert-butylphosphino)-1-phenylindole Usage And Synthesis

Reaction

  1. Useful ligand for the Pd-catalyzed amination reaction.
  2. Ligand used for the Pd-catalyzed arylation of phenols.
  3. Useful ligand for the Suzuki-Miyaura coupling.
  4. Ligand used for the Sonagashira reaction of aryl bromides.

Chemical Properties

White to yellow powder

Uses

N-Phenyl-2-(di-tert-butylphosphino)indole is a catalyst for the selective monoarylation of ammonia with different aryl bromides and chlorides.

General Description

sold in collaboration with Solvias AG

reaction suitability

reaction type: Asymmetric synthesis
reagent type: ligand
reaction type: Buchwald-Hartwig Cross Coupling Reaction
reagent type: ligand
reaction type: Sonogashira Coupling
reagent type: ligand
reaction type: Suzuki-Miyaura Coupling

Synthesis

1.6 ml (15 mmol) of TMEDA was added to 1.93 g (10 mmol) dissolved in 30 ml of hexanes within 1 . A solution of n-BuLi (6.25 ml, 10 mmol) (concentration 1.6 M in hexane) was added dropwise. after 3 hr reflux (75C), the color deepened from yellow to orange. Without cooling, 2.2 ml (10 mmol) of a solution of chlorinated di-tert-butylphosphine in 20 ml hexane was added dropwise. Refluxing was carried out for another hour, and the color of the mixture was again lightened and a white solid precipitated. After cooling, 30 ml of water was added to the mixture. Three extractions of the aqueous phase were carried out, each using 20 ml of hexane. The combined organic phases were washed with 10 ml of water, dried over Na2SO4 and concentrated under vacuum (45C). The yellow residue was boiled in 30 ml of MeOH for 30 min. After cooling to room temperature, the resulting product (660 mg, 17%) was filtered.

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