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CAS 898769-31-8

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1-(3,5-Dichlorophenyl)-3-(4-methylphenyl)-1-propanone

Description:
1-(3,5-Dichlorophenyl)-3-(4-methylphenyl)-1-propanone, also known by its CAS number 898769-31-8, is an organic compound characterized by its ketone functional group. This substance features a propanone backbone substituted with a 3,5-dichlorophenyl group and a 4-methylphenyl group, which contribute to its unique chemical properties. The presence of chlorine atoms enhances its lipophilicity and may influence its reactivity and biological activity. The compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its molecular structure suggests potential applications in organic synthesis and as an intermediate in the production of pharmaceuticals or agrochemicals. Additionally, the presence of aromatic rings may impart stability and influence the compound's interaction with biological systems. Safety data should be consulted for handling and exposure guidelines, as halogenated compounds can exhibit varying degrees of toxicity and environmental impact.
Formula:C16H14Cl2O
InChI:InChI=1S/C16H14Cl2O/c1-11-2-4-12(5-3-11)6-7-16(19)13-8-14(17)10-15(18)9-13/h2-5,8-10H,6-7H2,1H3
InChI key:InChIKey=UTQWUVZWCQAEGM-UHFFFAOYSA-N
SMILES:C(CCC1=CC=C(C)C=C1)(=O)C2=CC(Cl)=CC(Cl)=C2
Synonyms:
  • 1-(3,5-Dichlorophenyl)-3-(4-methylphenyl)-1-propanone
  • 1-Propanone, 1-(3,5-dichlorophenyl)-3-(4-methylphenyl)-
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