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CS-W001157 4
Total: USD 88.00

3-(3,4-Methylenedioxyphenyl)propionic acid

  • CAS No. 2815-95-4

  • Cat. No. CS-W015745
  • Purity≥97%
  • MDL No.MFCD00016909

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

3-(3,4-Methylenedioxyphenyl)propionic acid|CS-W015745

Structure of 2815-95-4

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General Information

  • CAS No. 2815-95-4
  • Cat. No. CS-W015745
  • Purity ≥97%
  • MDL No. MFCD00016909
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀O₄
  • Molecular Weight 194.19
  • Synonym(s) 1,3-Benzodioxole-5-propanoic acid
  • SMILES OC(=O)CCC1=CC=C2OCOC2=C1

Description

This propionic acid derivative features a methylenedioxyphenyl moiety that enhances electron density and metabolic stability. It integrates readily into bioactive scaffolds, serving as a key intermediate in the synthesis of pharmaceuticals and functional materials. The aromatic system supports robust coupling reactions under standard conditions.

Application

3-(3,4-Methylenedioxyphenyl)propionic acid serves as a versatile building block for the synthesis of bioactive molecules, particularly in medicinal chemistry and natural product analogs. Its benzodioxole ring imparts metabolic stability and favorable pharmacokinetic properties, while the carboxylic acid functionality enables straightforward derivatization via esterification, amide coupling, or decarboxylation. The compound exhibits good bench stability and is compatible with standard organic transformations, facilitating its use in multi-step syntheses.

Synthesis

  • Route1
    • null|null
      1162198-85-7
    • ~57%
    • In-stock
      3-(3,4-Methylenedioxyphenyl)propionic acid|CS-W015745
      2815-95-4
    • null|null
      607361-22-8

    References

    • Jia, Yaoling; Zhou, Pengfei; Wang, Yang; Dong, Xiaoyi; Liu, Xinhua; Pan, Lilong; Xin, Hong; Zhu, Yi Zhun European Journal of Medicinal Chemistry, 2012 , vol. 55, p. 176 - 187,12
  • Route2
    • 3-(Benzo[d][1,3]dioxol-5-yl)propan-1-ol|CS-1350335
      7031-03-0
    • ~91%
    • In-stock
      3-(3,4-Methylenedioxyphenyl)propionic acid|CS-W015745
      2815-95-4

    References

    • Lima, Patricia C.; Lima, Lidia M.; Da Silva, Kelli Cristine M.; Leda, Paulo Henrique O.; De Miranda, Ana Luisa P.; Fraga, Carlos A. M.; Barreiro, Eliezer J. European Journal of Medicinal Chemistry, 2000 , vol. 35, # 2 p. 187 - 203
  • Route3
    • null|null
      94-59-7
    • ~%
    • In-stock
      3-(3,4-Methylenedioxyphenyl)propionic acid|CS-W015745
      2815-95-4

    References

    • Barreiro, Eliazer J.; Costa, Paulo R. R.; Coelho, Fernando A. S.; Farias, Florence M. C. de Journal of Chemical Research, Miniprint, 1985 , # 7 p. 2301 - 2332

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-P330-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   55.76
  • LogP   1.4325
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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