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CS-W001157 4
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3-(1-Hydroxyethyl)benzoic acid

  • CAS No. 283608-37-7

  • Cat. No. CS-0154114
  • Purity≥97%
  • MDL No.MFCD09032018

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

3-(1-Hydroxyethyl)benzoic acid|CS-0154114

Structure of 283608-37-7

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General Information

  • CAS No. 283608-37-7
  • Cat. No. CS-0154114
  • Purity ≥97%
  • MDL No. MFCD09032018
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀O₃
  • Molecular Weight 166.17
  • Synonym(s) 3-(1-HYDROXY-ETHYL)-BENZOIC ACID
  • SMILES CC(C1=CC(=CC=C1)C(=O)O)O

Description

3-(1-Hydroxyethyl)benzoic acid features a benzoic acid core appended with a hydroxyethyl side chain, offering a balance of polarity and aromatic stability. This functionalized derivative integrates readily into synthetic routes requiring both carboxylic acid reactivity and secondary alcohol handle for further derivatization.

Application

3-(1-Hydroxyethyl)benzoic acid serves as a versatile building block for medicinal chemistry and synthetic organic applications, enabling efficient access to chiral biaryl motifs via standard coupling protocols. Its pendant hydroxyl group offers direct handle for derivatization—such as esterification or ether formation—while the carboxylic acid facilitates amide bond formation and metal coordination. The molecule exhibits good bench stability and is readily purified by recrystallization or chromatography, supporting scalable synthesis in process development workflows.

Synthesis

  • Route1

    References

    • Breschi, Maria C.; Calderone, Vincenzo; Digiacomo, Maria; Macchia, Marco; Martelli, Alma; Martinotti, Enrica; Minutolo, Filippo; Rapposelli, Simona; Rossello, Armando; Testai, Lara; Balsamo, Aldo Journal of Medicinal Chemistry, 2006 , vol. 49, # 8 p. 2628 - 2639
  • Route2
    • 3-(1-Hydroxyethyl)benzaldehyde|CS-1635372
      1313850-70-2
    • ~97%
    • In-stock
      3-(1-Hydroxyethyl)benzoic acid|CS-0154114
      283608-37-7

    References

    • Moehlmann, Lennart; Ludwig, Stefan; Blechert, Siegfried Beilstein Journal of Organic Chemistry, 2013 , vol. 9, p. 602 - 607

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   1.4381
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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