(4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone | CAS No. 91714-51-1

(4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone

Basic Information

CAS Number

91714-51-1

Molecular Formula

C15H9BrClNO

Molecular Weight

334.6 g/mol

AD

Basic Physical Properties

C1=CC2=C(C(=C1)C(=O)C3=CC=C(C=C3)Br)NC=C2Cl

InChI

InChI=1S/C15H9BrClNO/c16-10-6-4-9(5-7-10)15(19)12-3-1-2-11-13(17)8-18-14(11)12/h1-8,18H

InChIKey

AQGAUDHKENVWGE-UHFFFAOYSA-N

LogP

4.814800000000002

Topological Polar Surface Area

32.86 Ų

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

343

Synonyms & References

English

  • 3-Chloro-7-(4-Bromobenzoyl)indole
  • (4-Bromophenyl)(3-chloro-1H-indol-7-yl)methanone (ACI)
  • (4-bromophenyl)(3-chloro-1H-indol-7-yl)methanone
  • 91714-51-1
  • (4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone
  • 7-(4-BROMOBENZOYL)-3-CHLORO-1H-INDOLE
  • (4-Bromophenyl)(3-chloro-1H-indol-7-yl)methanone
  • AKOS000280164
  • (4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone;Methanone, (4-broMophenyl)(3-chloro-1H-indol-7-yl)-;3-chloro-7-(4-bromobenzoyl)-indole
  • Methanone, (4-bromophenyl)(3-chloro-1H-indol-7-yl)-
  • BCP29808
  • (4-bromophenyl)-(3-chloro-1H-indol-7-yl)methanone
  • 3-chloro-7-(4-bromobenzoyl)indole
  • ZCT97MC8E4

FAQ

What are the physical and chemical properties of (4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone (CAS: 91714-51-1)?

(4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone is a crystalline solid with a molecular weight of approximately 395.03 g/mol. It has a low solubility in water but is more soluble in organic solvents like ethanol and dichloromethane. The compound is moderately reactive, showing basic properties due to its indole ring. It is stable under normal laboratory conditions but should be stored in a cool, dry place away from direct sunlight.

How is (4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone (CAS: 91714-51-1) typically synthesized?

(4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone can be synthesized through a multi-step reaction starting from bromobenzene and 3-chloro-1H-indole. The process involves the formation of the bromophenyl group followed by the coupling with the indole ring. Common catalysts include palladium-based catalysts, and the reaction is typically carried out under microwave conditions to improve yield and selectivity. The overall yield is around 75-85%.

What industries use (4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone (CAS: 91714-51-1)?

(4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone finds application in the pharmaceutical industry, particularly in the development of new drug candidates. It can also be used in the synthesis of certain types of polymers and sensors. Due to its structural complexity, it is less commonly used in semiconductor applications but may find niche uses in advanced materials research.

What precautions should be taken when handling (4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone (CAS: 91714-51-1)?

When handling (4-Bromo-phenyl)-(3-chloro-1H-indol-7-yl)-methanone, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be stored in a sealed container and handled in a well-ventilated area or a fume hood. In case of a spill, it should be handled according to the safety data sheet (SDS) and cleaned up using appropriate absorbents. Always ensure that the compound is disposed of in an environmentally safe manner following local regulations and guidelines.

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