CAS 85979-61-9

4-Chloro-6-(4-fluorophenyl)pyrimidine

Description:

4-Chloro-6-(4-fluorophenyl)pyrimidine is a heterocyclic organic compound characterized by a pyrimidine ring substituted with a chlorine atom at the 4-position and a para-fluorophenyl group at the 6-position. This compound typically appears as a solid and is known for its role in medicinal chemistry, particularly in the development of pharmaceuticals. Its molecular structure contributes to its potential biological activity, making it a subject of interest in drug discovery. The presence of both chlorine and fluorine atoms enhances its lipophilicity and may influence its interaction with biological targets. Additionally, the compound's stability and reactivity can be affected by the electronic properties of the substituents on the pyrimidine ring. As with many heterocycles, it may exhibit a range of chemical behaviors, including participation in nucleophilic substitutions or coupling reactions. Safety data should be consulted for handling, as with any chemical substance, to ensure proper precautions are taken during its use in laboratory or industrial settings.

Formula: C₁₀H₆ClFN₂

InChI: InChI=1S/C10H6ClFN2/c11-10-5-9(13-6-14-10)7-1-3-8(12)4-2-7/h1-6H

InChI key: InChIKey=KYBYBOZNMFRRSF-UHFFFAOYSA-N

SMILES: ClC1=CC(=NC=N1)C2=CC=C(F)C=C2

Synonyms:

• Pyrimidine, 4-chloro-6-(4-fluorophenyl)-
• 4-Chloro-6-(4-fluorophenyl)pyrimidine