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CS-W001157 4
Total: USD 88.00

3-Phenoxypropionic acid

  • CAS No. 7170-38-9

  • Cat. No. CS-W004102
  • Purity≥98%
  • MDL No.MFCD00002769

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

3-Phenoxypropionic acid|CS-W004102

Structure of 7170-38-9

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General Information

  • CAS No. 7170-38-9
  • Cat. No. CS-W004102
  • Purity ≥98%
  • MDL No. MFCD00002769
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀O₃
  • Molecular Weight 166.17
  • Synonym(s) Propanoic acid, 3-phenoxy-
  • SMILES O=C(O)CCOC1=CC=CC=C1

Description

3-Phenoxypropionic acid is a bench-stable, moisture-tolerant carboxylic acid featuring a phenoxy-substituted propionic backbone. This structure integrates a polar functional group with an aromatic moiety, enabling robust coupling in synthetic sequences. The compound serves as a key building block for bioactive esters and polymer precursors, offering enhanced solubility and reactivity under standard conditions.

Application

3-Phenoxypropionic acid serves as a versatile building block in synthetic organic chemistry, enabling the construction of bioactive heterocycles and pharmaceutical intermediates. Its aromatic phenoxy group imparts enhanced lipophilicity and metabolic stability, while the carboxylic acid functionality facilitates straightforward derivatization via esterification, amidation, or coupling reactions. The compound exhibits good bench stability and is readily purified by recrystallization, making it well-suited for scale-up applications in medicinal chemistry and agrochemical synthesis.

Synthesis

  • Route1
    • null|null
      140-88-5
    • null|null
      108-95-2
    • ~27%
    • In-stock
      3-Phenoxypropionic acid|CS-W004102
      7170-38-9

    References

    • TRIN PHARMA GMBH Patent: US2010/234327 A1, 2010 ; Location in patent: Page/Page column 11; 15 ;
  • Route2
    • 3-Phenoxypropionitrile|CS-0204565
      3055-86-5
    • ~85%
    • In-stock
      3-Phenoxypropionic acid|CS-W004102
      7170-38-9

    References

    • Al-Awadi; Abdallah; Dib; Ibrahim; El-Dusouqui Tetrahedron, 2005 , vol. 61, # 24 p. 5769 - 5777
  • Route3

    References

    • Journal of the American Chemical Society, , vol. 45, p. 2711

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-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   1.5401
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   4

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