structure of 7-bromo-6-fluoro-1H-indole

7-bromo-6-fluoro-1H-indole

CAS No.: 1000339-62-7
M. Wt: 214.03400
M. Fa: C8H5BrFN
InChI Key: REKZBQHRHZATLM-UHFFFAOYSA-N

Names and Identifiers of 7-bromo-6-fluoro-1H-indole

CAS Number

1000339-62-7

EC Number

691-820-3

MDL Number

MFCD09749664

IUPAC Name

7-bromo-6-fluoro-1H-indole

InChI

InChI=1S/C8H5BrFN/c9-7-6(10)2-1-5-3-4-11-8(5)7/h1-4,11H

InChIKey

REKZBQHRHZATLM-UHFFFAOYSA-N

Canonical SMILES

C1=CC(=C(C2=C1C=CN2)Br)F

UNSPSC Code

12352100

Physical and chemical properties of 7-bromo-6-fluoro-1H-indole

Acidity coefficient

14.73±0.30(Predicted)

Boiling Point

315.9±22.0 °C(Predicted)

Density

1.750±0.06 g/cm3(Predicted)

Exact Mass

212.95900

LogP

3.06950

Molecular Formula

C8H5BrFN

Molecular Weight

214.03400

PSA

15.79000

Safety Information of 7-bromo-6-fluoro-1H-indole

Pictograms

Signal Word

Warning

Safety Data Sheet

Supports customized editing of SDS information and downloading in PDF documents.

Applications of 7-bromo-6-fluoro-1H-indole

7-Bromo-6-fluoro-1H-indole has several applications in:

  • Pharmaceutical Development: Due to its biological activity, it is being explored as a potential lead compound in drug discovery.
  • Chemical Research: It serves as a building block for synthesizing more complex organic molecules in research laboratories.

Interaction Studies of 7-bromo-6-fluoro-1H-indole

Studies on the interactions of 7-bromo-6-fluoro-1H-indole with biological targets are ongoing. Initial findings suggest that it may interact with specific receptors or enzymes involved in cancer progression or microbial resistance. Detailed interaction studies using techniques such as molecular docking and binding affinity assays are necessary to elucidate these mechanisms further.

Biological Activity of 7-bromo-6-fluoro-1H-indole

Research indicates that 7-bromo-6-fluoro-1H-indole exhibits significant biological activity. It has been studied for its potential as:

  • Anticancer Agent: Some studies suggest that this compound may inhibit cancer cell proliferation.
  • Antimicrobial Properties: Its derivatives have shown effectiveness against various bacterial strains.

The specific mechanisms through which it exerts these effects are still under investigation but may involve interactions with cellular signaling pathways.

Retrosynthesis analysis of 7-bromo-6-fluoro-1H-indole

  • Route#1

    Cas:59255-94-6
    Cas:1000339-62-7