structure of 6-Fluoro-4-nitro-1H-indole

6-Fluoro-4-nitro-1H-indole

CAS No.: 1000340-83-9
M. Wt: 180.136
M. Fa: C8H5FN2O2
InChI Key: QPJOZMDIVCTTCI-UHFFFAOYSA-N
Appearance: dark brown powder

Names and Identifiers of 6-Fluoro-4-nitro-1H-indole

CAS Number

1000340-83-9

MDL Number

MFCD09027054

IUPAC Name

6-fluoro-4-nitro-1H-indole

InChI

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

InChIKey

QPJOZMDIVCTTCI-UHFFFAOYSA-N

Canonical SMILES

C1=CNC2=C1C(=CC(=C2)F)[N+](=O)[O-]

UNSPSC Code

12352100

Physical and chemical properties of 6-Fluoro-4-nitro-1H-indole

Boiling Point

366.1±22.0 °C at 760 mmHg

Density

1.5±0.1 g/cm3

Exact Mass

180.033508

Flash Point

175.2±22.3 °C

H Bond Acceptors

2

H Bond Donors

1

Index of Refraction

1.690

LogP

1.82

Molecular Formula

C8H5FN2O2

Molecular Weight

180.136

PSA

61.61000

Storage condition

2-8°C

Vapour Pressure

0.0±0.8 mmHg at 25°C

Safety Information of 6-Fluoro-4-nitro-1H-indole

Pictograms

Signal Word

 Warning

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

Applications of 6-Fluoro-4-nitro-1H-indole

6-Fluoro-4-nitro-1H-indole finds applications in various fields:

  • Pharmaceuticals: It serves as a building block in the synthesis of biologically active compounds and potential drug candidates.
  • Material Science: Its derivatives are explored for use in organic electronics and photonic devices due to their unique electronic properties.
  • Chemical Probes: The compound can be utilized as a chemical probe in biological studies to understand cellular mechanisms and interactions.

Interaction Studies of 6-Fluoro-4-nitro-1H-indole

Studies on 6-fluoro-4-nitro-1H-indole focus on its interactions with biological targets:

  • Protein Binding Studies: Investigations into how this compound binds to specific proteins reveal insights into its mechanism of action and potential therapeutic applications.
  • Enzyme Inhibition: Research has shown that certain derivatives may inhibit key enzymes involved in metabolic pathways, which could be leveraged for therapeutic benefits.

Biological Activity of 6-Fluoro-4-nitro-1H-indole

Compounds containing the indole structure, including 6-fluoro-4-nitro-1H-indole, have been studied for various biological activities:

  • Anticancer Properties: Some derivatives exhibit cytotoxic effects against cancer cell lines, making them potential candidates for anticancer drug development.
  • Antimicrobial Activity: Certain nitroindoles have shown promising antimicrobial properties, which could be beneficial in treating bacterial infections.
  • Neuroprotective Effects: Research indicates that some indole derivatives may possess neuroprotective properties, potentially aiding in the treatment of neurodegenerative diseases.