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CS-W001157 4
Total: USD 88.00

3-(4-Chloro-3-fluorophenyl)propionic acid

  • CAS No. 881189-65-7

  • Cat. No. CS-W015492
  • Purity≥98%
  • MDL No.MFCD04116058

*For research and further manufacturing use only, not for direct human use.

3-(4-Chloro-3-fluorophenyl)propionic acid|CS-W015492

Structure of 881189-65-7

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General Information

  • CAS No. 881189-65-7
  • Cat. No. CS-W015492
  • Purity ≥98%
  • MDL No. MFCD04116058
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈ClFO₂
  • Molecular Weight 202.61
  • Synonym(s) 4-chloro-3-fluoroBenzenepropanoic acid
  • SMILES O=C(O)CCC1=CC=C(Cl)C(F)=C1

Description

This propionic acid derivative features a 4-chloro-3-fluorophenyl group linked via a three-carbon chain, offering enhanced electronic and steric properties. The fluorine and chlorine substituents impart electron-withdrawing character, improving metabolic stability and enabling selective functionalization in medicinal chemistry applications.

Application

3-(4-Chloro-3-fluorophenyl)propionic acid serves as a versatile building block for medicinal chemistry and agrochemical synthesis, enabling the construction of biologically active scaffolds. Its ortho-halogenated aryl group provides enhanced metabolic stability and facilitates downstream coupling reactions. The carboxylic acid functionality offers direct handle for derivatization via amide, ester, or acyl chloride formation, with excellent bench stability and straightforward purification.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.4963
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   3

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