454-73-9

Basic information

• Product Name: 3-FLUORO-5-NITROBENZOTRIFLUORIDE
• Synonyms: 3-FLUORO-5-NITRO-1-TRIFLUOROMETHYLBENZENE;3-FLUORO-5-NITROBENZOTRIFLUORIDE;3-Fluoro-5-(trifluoromethyl)nitrobenzene;3-FLUORO-5-NITRO-1-TRIFLUOROMETHYLBENZENE 98%;3-fluoro-5-nitrobenzotrifluoride 3-Fluoro-5-(trifluoromethyl)nitrobenzene;3-Fuoro-5-nitrobenzotrifluoride;1-Fluoro-3-nitro-5-(trifluoroMethyl)benzene;Benzene, 1-fluoro-3-nitro-5-(trifluoroMethyl)-
• CAS NO: 454-73-9
• Molecular Formula: C₇H₃F₄NO₂
• Molecular Weight: 209.1
• Product Categories: Fluorine series
• Mol File: 454-73-9.mol
• Article Data: 5

Chemical Properties

• Boiling Point: 186.028 °C at 760 mmHg
• Flash Point: 66.308 °C
• Appearance: /
• Density: 1.504 g/cm³
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility: Chloroform, Methanol
• CAS DataBase Reference: 3-FLUORO-5-NITROBENZOTRIFLUORIDE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-FLUORO-5-NITROBENZOTRIFLUORIDE(454-73-9)
• EPA Substance Registry System: 3-FLUORO-5-NITROBENZOTRIFLUORIDE(454-73-9)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36
• Hazardous Substances Data: 454-73-9(Hazardous Substances Data)

Usage

Description

3-Fluoro-5-nitrobenzotrifluoride is a tri-substituted benzene derivative characterized by the presence of a fluorine atom at the 3rd position and a nitro group at the 5th position, along with three trifluoromethyl groups. This organic compound is known for its unique chemical properties and reactivity, making it a valuable intermediate in the synthesis of various pharmaceutical compounds.

Uses

Used in Pharmaceutical Industry:
3-Fluoro-5-nitrobenzotrifluoride is used as a key intermediate in the synthesis of androgen receptor modulators and other pharmaceutical compounds. Its unique structure and reactivity allow for the development of novel drugs with potential therapeutic applications in various medical conditions.
Used in Organic Synthesis:
3-Fluoro-5-nitrobenzotrifluoride serves as a versatile building block in organic synthesis, enabling the creation of a wide range of chemical compounds with diverse applications. Its tri-substituted benzene core can be further modified and functionalized to produce various organic molecules for use in different industries, including pharmaceuticals, agrochemicals, and materials science.
Used in Research and Development:
As a tri-substituted benzene derivative, 3-Fluoro-5-nitrobenzotrifluoride is also utilized in research and development settings to explore its chemical properties, reactivity, and potential applications. This can lead to the discovery of new synthetic routes, reaction mechanisms, and innovative uses for this compound in various fields.

Upstream product

• 3819-88-3 1-fluoro-3-iodo-5-nitrobenzene 
• 401-99-0 3,5-dinitrobenzotrifluoride 
• 393-75-9 4-chloro-3,5-dinitrobenzotrifluoride 

Downstream Products

• 402-02-8 acetic acid-(3-fluoro-5-trifluoromethyl-anilide) 
• 916975-92-3 4-methyl-1-(3-nitro-5-(trifluoromethyl)-phenyl)-1H-imidazole 
• 1107062-37-2 1-(4-(methylsulfonyl)phenoxy)-3-nitro-5-(trifluoromethyl)benzene 

Relevant articles and documents

UREA AND BIS-UREA BASED COMPOUNDS AND ANALOGUES THEREOF USEFUL IN THE TREATMENT OF ANDROGEN RECEPTOR MEDIATED DISEASES OR DISORDERS

Urea-based and bis-urea based compounds and analogues thereof are disclosed. These compounds are useful in the treatment of androgen-dependent diseases or disorders and androgen receptor-mediated diseases or disorders. Specifically, the compounds are useful in the treatment of diseases or disorders that are AR negative.

Antibacterial agents

Hydroxyamidines and related compounds are provided which are suitable as antibacterial agents.

Nucleophilic Substitution of Nitro Group in 3,5-Dinitrobenzotrifluoride

In the reaction of 3,5-dinitrobenzotrifluoride with phenols and thiophenol in the presence of potassium carbonate, fluoride- and nitrite-ions in DMF at 25-145°C, substitution of a nitro group takes place with formation of the corresponding 3-nitro-5-R-benzotrifluorides.