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TCI

CAS 400-98-6

4-Amino-3-nitrobenzotrifluoride TCI A0376

4-Amino-3-nitrobenzotrifluoride TCI A0376

Chemical Identity

CAS No.
400-98-6
PubChem
CID 67865·SID 87562019
Formula
C7H5F3N2O2
Molecular weight
206.12 g/mol
Purity
>99.0%(GC)
Reference databases
ECHA
Full identifiers (IUPAC, SMILES, InChIKey)
IUPAC
2-nitro-4-(trifluoromethyl)aniline
SMILES
C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])N
InChIKey
ATXBGHLILIABGX-UHFFFAOYSA-N
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4-Amino-3-nitrobenzotrifluoride is a chemical compound that plays a significant role in laboratory settings, particularly in organic and pharmaceutical research. As a fluorinated building block, it serves as a versatile intermediate in the synthesis of complex molecules. Its unique molecular structure, featuring both amino and nitro functional groups, makes it a valuable tool for chemists aiming to create new compounds with specific biological activities. This compound is widely used in synthetic pathways where controlled reactivity and functional group manipulation are essential.

The compound's chemical properties, including its reactivity and stability under certain conditions, make it a preferred choice for various synthetic reactions. Its ability to participate in substitution and oxidation reactions allows for the development of a wide range of derivatives. The presence of fluorine atoms in its structure also contributes to its unique reactivity profile, enabling it to interact with a variety of reagents. These characteristics make it an essential component in the toolkit of synthetic chemists working in both academic and industrial laboratories.

In Indonesian laboratories, 4-Amino-3-nitrobenzotrifluoride is commonly used in organic chemistry research, especially in the development of new bioactive compounds. Its relevance extends to pharmaceutical and environmental chemistry, where it is employed in the study of complex chemical reactions. The compound is frequently utilized in the synthesis of pharmaceutical intermediates and in the investigation of new chemical structures with potential therapeutic applications.

  • Organic synthesis of pharmaceutical intermediates due to its reactivity and functional group versatility.
  • Development of bioactive compounds in medicinal chemistry research for drug discovery applications.
  • Environmental chemistry studies involving complex chemical reactions and pollutant transformation processes.
  • Creation of fluorinated derivatives for advanced materials and specialty chemical applications.
  • Investigation of substitution and oxidation reactions in synthetic pathway optimization.

Brand TCI
CAS number 400-98-6
Molecular formula —
Purity —
Category Chemistry > Building Blocks > Fluorinated Building Blocks
Pack sizes Available in standard laboratory quantities
Physical form Solid, crystalline appearance
Storage Store in a cool, dry place away from light and moisture

This compound should be stored in a cool, dry environment, away from direct sunlight and moisture. It is recommended to use airtight containers made of materials that are chemically inert to prevent any unwanted reactions. Due to its reactivity, it should be handled with care, using appropriate personal protective equipment such as gloves and safety goggles. Proper ventilation is essential when working with this material to minimize exposure. It should not be stored near incompatible substances such as strong oxidizers or acids. Regular inspection of storage conditions is advised to ensure the integrity and safety of the compound.

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