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CS-W001157 4
Total: USD 88.00

3-Hydroxybenzamide

  • CAS No. 618-49-5

  • Cat. No. CS-0149666
  • Purity≥98%
  • MDL No.MFCD00017572

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

3-Hydroxybenzamide|CS-0149666

Structure of 618-49-5

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General Information

  • CAS No. 618-49-5
  • Cat. No. CS-0149666
  • Purity ≥98%
  • MDL No. MFCD00017572
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇NO₂
  • Molecular Weight 137.14
  • Synonym(s) Benzamide,3-hydroxy
  • SMILES OC1=CC=CC(C(N)=O)=C1

Description

3-Hydroxybenzamide features a phenolic hydroxyl group ortho to an amide functionality, enabling dual hydrogen-bonding interactions. This structural motif enhances solubility and facilitates integration into bioactive scaffolds. The compound serves as a key intermediate in the synthesis of pharmaceuticals and functionalized aromatic systems.

Application

3-Hydroxybenzamide serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocycles and pharmaceutical scaffolds. Its ortho-hydroxyl and amide functionalities offer complementary reactivity for coupling reactions, metal-catalyzed transformations, and derivatization under mild conditions. The compound exhibits good bench stability and facilitates purification via crystallization or chromatography, supporting its use in iterative synthesis workflows.

Synthesis

  • Route1
    • 3-Hydroxybenzaldehyde Roxatidine Impurity|CS-0229483
      100-83-4
    • ~91%
    • In-stock
      3-Hydroxybenzamide|CS-0149666
      618-49-5

    References

    • Sharghi, Hashem; Sarvari, Mona Hosseini Tetrahedron, 2002 , vol. 58, # 52 p. 10323 - 10328
  • Route2

    References

    • McKillop, Alexander; Kemp, Duncan Tetrahedron, 1989 , vol. 45, # 11 p. 3299 - 3306
  • Route3
    • null|null
      40812-76-8
    • ~%
    • In-stock
      3-Hydroxybenzamide|CS-0149666
      618-49-5

    References

    • Justus Liebigs Annalen der Chemie, , vol. 442, p. 41

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-H319
Precautionary Statements : P264-P270-P280-P501

Quality Control

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Computational Chemistry Data

  • TPSA   63.32
  • LogP   0.4911
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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