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CS-W001157 4
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4-(Octyloxy)benzoic acid

  • CAS No. 2493-84-7

  • Cat. No. CS-0147091
  • Purity≥98%
  • MDL No.None

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

4-(Octyloxy)benzoic acid|CS-0147091

Structure of 2493-84-7

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General Information

  • CAS No. 2493-84-7
  • Cat. No. CS-0147091
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₂₂O₃
  • Molecular Weight 250.33
  • Synonym(s) p-Octoxybenzoic acid
  • SMILES O=C(O)C1=CC=C(OCCCCCCCC)C=C1

Description

4-(Octyloxy)benzoic acid features a long aliphatic chain that imparts enhanced solubility in organic media while retaining the carboxylic acid functionality for derivatization. This amphiphilic architecture supports integration into surfactant systems, polymer side chains, or bioconjugation platforms requiring tailored hydrophobicity and reactive handles.

Application

4-(Octyloxy)benzoic acid serves as a versatile building block for amphiphilic architectures, enabling the synthesis of surfactants and functional materials through esterification or amidation. Its aliphatic tail imparts solubility in nonpolar media, while the carboxylic acid group facilitates coupling reactions under standard conditions. The compound exhibits good bench stability and is readily purified by recrystallization, making it well-suited for use in formulation chemistry and polymer synthesis.

Synthesis

  • Route1

    References

    • Journal of Chemical Physics, , vol. 92, # 6 p. 3917 - 3929
  • Route2

    References

    • BASF AKTIENGESELLSCHAFT Patent: WO2004/2979 A2, 2004 ; Location in patent: Page/Page column 23-24 ;
  • Route3

    References

    • US4293482 A1, ;

Safety Information

Download SDS
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-P302+P352-P304+P340

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   4.1241
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   9

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