CAS 79707-09-8

3-Chloro-4-oxopentanenitrile

Description:

3-Chloro-4-oxopentanenitrile, with the CAS number 79707-09-8, is an organic compound characterized by the presence of a chloro group, a nitrile functional group, and a ketone functionality within a five-carbon chain. This compound typically appears as a colorless to pale yellow liquid or solid, depending on its specific form and purity. It is soluble in organic solvents, which is common for compounds containing nitrile and carbonyl groups. The presence of the chloro substituent can impart unique reactivity, making it a potential intermediate in organic synthesis, particularly in the production of pharmaceuticals and agrochemicals. The compound's reactivity may include nucleophilic substitution and addition reactions due to the electrophilic nature of the carbonyl group and the nitrile functionality. Safety data sheets should be consulted for handling precautions, as halogenated compounds can pose health risks. Overall, 3-Chloro-4-oxopentanenitrile serves as a valuable building block in synthetic organic chemistry.

Formula: C₅H₆ClNO

InChI: InChI=1S/C5H6ClNO/c1-4(8)5(6)2-3-7/h5H,2H2,1H3

InChI key: InChIKey=BARSEKTZFIILTJ-UHFFFAOYSA-N

SMILES: C(CC#N)(C(C)=O)Cl

Synonyms:

• Pentanenitrile, 3-chloro-4-oxo-
• 3-Chloro-4-oxopentanenitrile