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CAS 2168-06-1

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4-Chloro-β,β-bis(4-chlorophenyl)benzenepropanoic acid

Description:
4-Chloro-β,β-bis(4-chlorophenyl)benzenepropanoic acid, with the CAS number 2168-06-1, is an organic compound characterized by its complex structure, which includes multiple aromatic rings and a propanoic acid functional group. This substance is a derivative of phenylpropanoic acid, featuring two 4-chlorophenyl groups attached to the β-carbon of the propanoic acid moiety. The presence of chlorine substituents enhances its lipophilicity and may influence its biological activity. Typically, compounds of this nature exhibit properties such as moderate to high melting points and solubility in organic solvents, while being less soluble in water due to their hydrophobic characteristics. The compound may also exhibit potential applications in pharmaceuticals or agrochemicals, given the structural motifs common in biologically active molecules. Additionally, its synthesis and handling require careful consideration of safety protocols due to the presence of chlorine, which can pose environmental and health risks. Overall, 4-Chloro-β,β-bis(4-chlorophenyl)benzenepropanoic acid is a notable compound in organic chemistry with implications in various fields.
Formula:C21H15Cl3O2
InChI:InChI=1S/C21H15Cl3O2/c22-17-7-1-14(2-8-17)21(13-20(25)26,15-3-9-18(23)10-4-15)16-5-11-19(24)12-6-16/h1-12H,13H2,(H,25,26)
InChI key:InChIKey=LHIVWYJOCNGZRI-UHFFFAOYSA-N
SMILES:C(CC(O)=O)(C1=CC=C(Cl)C=C1)(C2=CC=C(Cl)C=C2)C3=CC=C(Cl)C=C3
Synonyms:
  • 3,3,3-Tris(4-Chlorophenyl)Propanoic Acid
  • 3,3,3-Tris(p-chlorophenyl)propionic acid
  • 4-Chloro-β,β-bis(4-chlorophenyl)benzenepropanoic acid
  • Benzenepropanoic acid, 4-chloro-β,β-bis(4-chlorophenyl)-
  • Propionic acid, 3,3,3-tris(p-chlorophenyl)-
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