1211537-27-7 | 6-Cyano-2-(trifluoromethyl)nicotinic acid

Packsize	Purity	Availability	Price	Discounted Price
50mg	95%	in stock	$356.00	$249.00
100mg	95%	in stock	$606.00	$424.00
250mg	95%	in stock	$1,035.00	$724.00

Description

• Catalog Number: AB50353
• Chemical Name: 6-Cyano-2-(trifluoromethyl)nicotinic acid
• CAS Number: 1211537-27-7
• Molecular Formula: C8H3F3N2O2
• Molecular Weight: 216.1168
• MDL Number: MFCD18256578
• SMILES: N#Cc1ccc(c(n1)C(F)(F)F)C(=O)O

Computed Properties

• Complexity: 307
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 7
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 1.4

Upstream Synthesis Route

6-Cyano-2-(trifluoromethyl)nicotinic acid, also known as $name$, is a versatile compound widely used in chemical synthesis. Its unique chemical structure makes it a valuable building block in organic reactions and the creation of complex molecular structures. In chemical synthesis, $name$ serves as a key intermediate in the preparation of various pharmaceuticals, agrochemicals, and specialty chemicals. Its cyano and trifluoromethyl functional groups offer a range of reactivity and selectivity in reactions, allowing for the introduction of essential functional groups and stereochemistry control. Moreover, the presence of the nicotinic acid backbone further enhances its utility in constructing biologically active molecules. Overall, $name$ plays a crucial role in advancing synthetic methodologies and accelerating the discovery of novel compounds with potential industrial applications.