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CS-W001157 4
Total: USD 88.00

5-(4-Chlorophenyl)pentanoic acid

  • CAS No. 161725-12-8

  • Cat. No. CS-0163340
  • Molecule weight212.67
  • Purity≥98%
  • MDL No.None

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

5-(4-Chlorophenyl)pentanoic acid|CS-0163340

Structure of 161725-12-8

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General Information

  • CAS No. 161725-12-8
  • Cat. No. CS-0163340
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃ClO₂
  • Molecular Weight 212.67
  • Synonym(s) 5-(4-chlorokphenyl)pentanoic acid
  • SMILES O=C(O)CCCCC1=CC=C(Cl)C=C1

Description

5-(4-Chlorophenyl)pentanoic acid features a hydrophobic chlorophenyl group linked via a flexible pentanoic chain, enabling integration into bioactive scaffolds. This structure supports modular derivatization in medicinal chemistry, particularly for targeting receptor-ligand interactions where lipophilicity enhances membrane permeability. The carboxylic acid moiety facilitates conjugation or salt formation under standard conditions.

Application

5-(4-Chlorophenyl)pentanoic acid serves as a versatile building block for pharmaceutical and agrochemical synthesis, enabling the construction of bioactive scaffolds through standard coupling and functionalization reactions. Its aliphatic carboxylic acid functionality facilitates amide, ester, and acyl chloride transformations, while the para-chlorophenyl group provides orthogonal reactivity and enhanced metabolic stability. The compound exhibits good bench stability, ease of purification, and compatibility with common protecting group strategies in multi-step syntheses.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   3.1374
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   5

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