structure of 4-Fluoro-2-(methylsulfonyl)phenol

4-Fluoro-2-(methylsulfonyl)phenol

CAS No.: 1000339-69-4
M. Wt: 190.192
M. Fa: C7H7FO3S
InChI Key: KWWNBJSKFLDCBH-UHFFFAOYSA-N
Appearance: Solid

Names and Identifiers of 4-Fluoro-2-(methylsulfonyl)phenol

CAS Number

1000339-69-4

MDL Number

MFCD09264546

IUPAC Name

4-fluoro-2-methylsulfonylphenol

InChI

InChI=1S/C7H7FO3S/c1-12(10,11)7-4-5(8)2-3-6(7)9/h2-4,9H,1H3

InChIKey

KWWNBJSKFLDCBH-UHFFFAOYSA-N

Canonical SMILES

CS(=O)(=O)C1=C(C=CC(=C1)F)O

UNSPSC Code

12352100

Physical and chemical properties of 4-Fluoro-2-(methylsulfonyl)phenol

Boiling Point

376.9±42.0 °C at 760 mmHg

Density

1.4±0.1 g/cm3

Exact Mass

190.009995

Flash Point

181.7±27.9 °C

Index of Refraction

1.538

LogP

1.32

Melting Point

122～123℃

Molecular Formula

C7H7FO3S

Molecular Weight

190.192

Vapour Pressure

0.0±0.9 mmHg at 25°C

Safety Information of 4-Fluoro-2-(methylsulfonyl)phenol

Pictograms

Signal Word

 Warning

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

Applications of 4-Fluoro-2-(methylsulfonyl)phenol

This compound finds applications across multiple fields:

  • Pharmaceutical Industry: Used as an intermediate in the synthesis of active pharmaceutical ingredients.
  • Material Science: Serves as a building block for functional polymers and graft polymers.
  • Chemical Research: Acts as a reagent in various organic synthesis reactions, particularly those involving carbon-carbon bond formation.

Interaction Studies of 4-Fluoro-2-(methylsulfonyl)phenol

Interaction studies involving 4-Fluoro-2-(methylsulfonyl)phenol have primarily focused on its role in biochemical pathways, especially those related to drug development. The compound has been shown to interact effectively with various biological targets, facilitating the formation of new compounds through reactions like the Suzuki–Miyaura coupling. These interactions are crucial for understanding how this compound can be utilized in developing novel therapeutics.

Biological Activity of 4-Fluoro-2-(methylsulfonyl)phenol

The biological activity of 4-Fluoro-2-(methylsulfonyl)phenol has garnered attention, particularly in pharmacological contexts. It has been identified as a potential building block for active pharmaceutical ingredients due to its selective inhibition properties over receptor tyrosine kinases. This selectivity enhances its utility in medicinal chemistry, particularly for developing compounds that target specific biological pathways. Furthermore, it has been noted for its role in stabilizing hepatocytes in certain quinazolines, indicating potential therapeutic applications.