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CAS 898761-27-8

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5-Chloro-1-(3-fluoro-4-methylphenyl)-1-pentanone

Description:
5-Chloro-1-(3-fluoro-4-methylphenyl)-1-pentanone is an organic compound characterized by its ketone functional group and the presence of halogen substituents. The molecular structure features a pentanone backbone, which is a five-carbon chain terminating in a carbonyl group (C=O). The compound includes a chloro group at the fifth carbon and a substituted phenyl group at the first carbon, specifically a 3-fluoro-4-methylphenyl moiety, indicating the presence of both a fluorine atom and a methyl group on the aromatic ring. This configuration contributes to its unique chemical properties, including potential reactivity and solubility characteristics influenced by the electronegative halogen atoms. The compound may exhibit moderate to high lipophilicity due to its hydrophobic alkyl chain and aromatic system, which can affect its behavior in biological systems and its applications in pharmaceuticals or agrochemicals. Additionally, the presence of halogens often enhances the compound's stability and can influence its interaction with biological targets. Safety and handling precautions should be observed due to the potential toxicity associated with halogenated compounds.
Formula:C12H14ClFO
InChI:InChI=1S/C12H14ClFO/c1-9-5-6-10(8-11(9)14)12(15)4-2-3-7-13/h5-6,8H,2-4,7H2,1H3
InChI key:InChIKey=WSLAWWCSIYHXOS-UHFFFAOYSA-N
SMILES:C(CCCCCl)(=O)C1=CC(F)=C(C)C=C1
Synonyms:
  • 5-Chloro-1-(3-fluoro-4-methylphenyl)-1-pentanone
  • 1-Pentanone, 5-chloro-1-(3-fluoro-4-methylphenyl)-
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