CAS 898767-68-5
:5-(3-chlorophenyl)-5-oxo-pentanenitrile
Description:
5-(3-Chlorophenyl)-5-oxo-pentanenitrile, with the CAS number 898767-68-5, is an organic compound characterized by its functional groups and structural features. It contains a pentanenitrile backbone, which is a five-carbon chain terminated by a nitrile group (-C≡N), indicating the presence of a carbon triple-bonded to nitrogen. The compound also features a ketone functional group (5-oxo) at the fifth carbon, contributing to its reactivity and potential applications in organic synthesis. The presence of a 3-chlorophenyl group indicates that there is a phenyl ring substituted with a chlorine atom at the meta position, which can influence the compound's electronic properties and reactivity. This substitution can also affect the compound's solubility and interaction with biological systems. Overall, 5-(3-chlorophenyl)-5-oxo-pentanenitrile is of interest in various fields, including pharmaceuticals and materials science, due to its unique structural characteristics and potential for further chemical modifications.
Formula:C11H10ClNO
InChI:InChI=1/C11H10ClNO/c12-10-5-3-4-9(8-10)11(14)6-1-2-7-13/h3-5,8H,1-2,6H2
SMILES:C(CC#N)CC(=O)c1cccc(c1)Cl
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