CAS 97603-40-2

3-(4-Chloro-2-pyrimidinyl)benzaldehyde

Description:

3-(4-Chloro-2-pyrimidinyl)benzaldehyde is an organic compound characterized by its aromatic structure, which includes a benzaldehyde moiety and a pyrimidine ring. The presence of the chloro substituent at the para position of the pyrimidine enhances its reactivity and influences its chemical properties. This compound typically appears as a solid at room temperature and is soluble in organic solvents such as ethanol and dichloromethane, but may have limited solubility in water due to its hydrophobic aromatic components. It is often utilized in organic synthesis and medicinal chemistry, serving as an intermediate in the production of various pharmaceuticals and agrochemicals. The compound's reactivity can be attributed to the electrophilic nature of the aldehyde group, making it suitable for further functionalization reactions. Additionally, the presence of the pyrimidine ring may impart biological activity, making it a subject of interest in drug discovery and development. Safety precautions should be observed when handling this compound, as it may pose health risks if ingested or inhaled.

Formula: C₁₁H₇ClN₂O

InChI: InChI=1S/C11H7ClN2O/c12-10-4-5-13-11(14-10)9-3-1-2-8(6-9)7-15/h1-7H

InChI key: InChIKey=SZHUIQFRNWOQJU-UHFFFAOYSA-N

SMILES: C(=O)C=1C=C(C=CC1)C=2N=C(Cl)C=CN2

Synonyms:

• 3-(4-Chloro-2-pyrimidinyl)benzaldehyde
• Benzaldehyde, 3-(4-chloro-2-pyrimidinyl)-