structure of 4-fluoro-5-nitro-1H-indole

4-fluoro-5-nitro-1H-indole

CAS No.: 1003858-69-2
M. Wt: 180.13600
M. Fa: C8H5FN2O2
InChI Key: UTYWHDIQWCMUNW-UHFFFAOYSA-N
Appearance: Yellow Solid

Names and Identifiers of 4-fluoro-5-nitro-1H-indole

CAS Number

1003858-69-2

MDL Number

MFCD26408173

IUPAC Name

4-fluoro-5-nitro-1H-indole

InChI

InChI=1S/C8H5FN2O2/c9-8-5-3-4-10-6(5)1-2-7(8)11(12)13/h1-4,10H

InChIKey

UTYWHDIQWCMUNW-UHFFFAOYSA-N

Canonical SMILES

C1=CC(=C(C2=C1NC=C2)F)[N+](=O)[O-]

UNSPSC Code

12352100

Physical and chemical properties of 4-fluoro-5-nitro-1H-indole

Exact Mass

180.03400

H Bond Acceptors

2

H Bond Donors

1

LogP

2.73840

Molecular Formula

C8H5FN2O2

Molecular Weight

180.13600

PSA

61.61000

Storage condition

2-8℃

Safety Information of 4-fluoro-5-nitro-1H-indole

Pictograms

Signal Word

Warning

Safety Data Sheet

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

Applications of 4-fluoro-5-nitro-1H-indole

The applications of 4-fluoro-5-nitro-1H-indole are diverse:

  • Pharmaceuticals: Due to its biological activity, it serves as a scaffold for designing new drugs targeting various diseases.
  • Research: It is used in studies aimed at understanding the mechanisms of action of indole-based compounds and their derivatives.

Interaction Studies of 4-fluoro-5-nitro-1H-indole

Interaction studies have shown that 4-fluoro-5-nitro-1H-indole can interact with various biological targets:

  • Protein Binding: Investigations into how this compound binds to proteins can reveal insights into its mechanism of action and potential therapeutic effects.
  • Receptor Activity: Studies on its interaction with specific receptors may help elucidate its role in modulating biological pathways.

Biological Activity of 4-fluoro-5-nitro-1H-indole

4-Fluoro-5-nitro-1H-indole exhibits notable biological activities:

  • Antimicrobial Properties: Research indicates that derivatives of this compound possess antimicrobial activities, making them potential candidates for developing new antibiotics.
  • Anticancer Potential: Some studies have suggested that indole derivatives can inhibit cancer cell proliferation, pointing to their potential in cancer therapy.

Physical sample testing spectrum (NMR) of 4-fluoro-5-nitro-1H-indole

Physical sample testing spectrum (NMR) of 4-fluoro-5-nitro-1H-indole