116548-04-0 | 2-hydroxy-6-(trifluoromethyl)pyridine-3-carbonitrile

Packsize	Purity	Availability	Price	Discounted Price
250mg	95%	in stock	$89.00	$62.00
1g	95%	in stock	$201.00	$141.00
5g	95%	in stock	$660.00	$462.00
10g	95%	in stock	$1,111.00	$778.00

Description

• Catalog Number: AA16341
• Chemical Name: 2-hydroxy-6-(trifluoromethyl)pyridine-3-carbonitrile
• CAS Number: 116548-04-0
• Molecular Formula: C7H3F3N2O
• Molecular Weight: 188.1067
• MDL Number: MFCD09749653
• SMILES: N#Cc1ccc([nH]c1=O)C(F)(F)F

Computed Properties

• Complexity: 356
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 1
• XLogP3: 1

Upstream Synthesis Route

2-Oxo-6-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile is a versatile compound widely utilized in chemical synthesis due to its unique reactivity and structural properties. This compound serves as a valuable building block in the synthesis of various pharmaceuticals, agrochemicals, and materials.Its electron-deficient nature makes it an excellent substrate for a range of organic transformations, including nucleophilic additions, cycloadditions, and heterocycle formations. In particular, the trifluoromethyl group enhances the compound's lipophilicity and stability, making it a valuable component in drug design and discovery.Furthermore, the presence of the cyano group provides a handle for further functionalization, allowing for the introduction of additional complexity and diversity in molecular structures. This enables chemists to access a wide array of novel compounds with potential biological activities or material properties.Overall, 2-Oxo-6-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile is a valuable tool in the hands of synthetic chemists, enabling the efficient construction of complex molecules with diverse applications in the fields of medicine, agriculture, and materials science.