1897-50-3 | 1,3-Benzenedicarbonitrile, 5-chloro-2,4,6-trifluoro-

Packsize	Purity	Availability	Price	Discounted Price
100mg	95%	in stock	$115.00	$80.00
250mg	95%	in stock	$179.00	$125.00

Description

• Catalog Number: AB11156
• Chemical Name: 1,3-Benzenedicarbonitrile, 5-chloro-2,4,6-trifluoro-
• CAS Number: 1897-50-3
• Molecular Formula: C8ClF3N2
• Molecular Weight: 216.5472
• MDL Number: MFCD06658269
• SMILES: N#Cc1c(F)c(C#N)c(c(c1F)Cl)F

Computed Properties

• Complexity: 287
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 5
• XLogP3: 2.3

Upstream Synthesis Route

5-Chloro-2,4,6-trifluoroisophthalonitrile, also known as $name$, serves as a versatile building block in chemical synthesis due to its unique properties and reactivity. This compound is commonly utilized in the pharmaceutical and agrochemical industries for the synthesis of novel molecules with desired biological activities. By incorporating $name$ into the molecular structure of target compounds, chemists can introduce fluorine atoms for enhancing bioavailability and metabolic stability. Additionally, the presence of the chloro group enables further functionalization through various chemical reactions, allowing for the creation of diverse chemical libraries for drug discovery and development purposes. Its trifluoromethyl substituents contribute to the compound's electron-withdrawing nature, which can impact the reactivity and physicochemical properties of the final products. In summary, the strategic incorporation of 5-Chloro-2,4,6-trifluoroisophthalonitrile in chemical synthesis can enable the synthesis of new and potent compounds with potential applications in various industries.

Literature

• Synthesis and antimicrobial activity of polyhalo isophthalonitrile derivatives.

  Bioorganic & medicinal chemistry letters 20130415