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CS-W001157 4
Total: USD 88.00

Ethyl 4-hydrazinylbenzoate hydrochloride

  • CAS No. 40566-85-6

  • Cat. No. CS-0151753
  • Purity≥97%
  • MDL No.MFCD03840413

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

Ethyl 4-hydrazinylbenzoate hydrochloride|CS-0151753

Structure of 40566-85-6

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General Information

  • CAS No. 40566-85-6
  • Cat. No. CS-0151753
  • Purity ≥97%
  • MDL No. MFCD03840413
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₃ClN₂O₂
  • Molecular Weight 216.66
  • Synonym(s) Benzoic acid, 4-hydrazino-, ethyl ester, Monohydrochloride
  • SMILES CCOC(=O)C1=CC=C(C=C1)NN.Cl

Description

Ethyl 4-hydrazinylbenzoate hydrochloride features a hydrazino group enabling direct coupling in heterocycle synthesis. This bench-stable derivative delivers high reactivity under mild conditions, facilitating efficient access to substituted pyrazoles and related scaffolds. The hydrochloride salt enhances solubility and handling in aqueous or polar organic media.

Application

Ethyl 4-hydrazinylbenzoate hydrochloride serves as a versatile building block for the synthesis of hydrazine-containing heterocycles and pharmaceutical intermediates. Its hydrazino group enables reliable condensation reactions with carbonyl compounds, facilitating access to pyrazole and triazole derivatives under mild conditions. The hydrochloride salt enhances bench stability and simplifies handling, while the ethyl ester supports downstream transformations such as hydrolysis or coupling. Functions effectively in standard organic synthesis workflows requiring controlled hydrazine reactivity.

Synthesis

  • Route1
    • null|null
      89101-11-1
    • ~79%
    • In-stock
      Ethyl 4-hydrazinylbenzoate hydrochloride|CS-0151753
      40566-85-6

    References

    • Kuo; Lee; Yeh Journal of the Chinese Chemical Society, 2000 , vol. 47, # 1 p. 227 - 240
  • Route2
    • null|null
      64-17-5
    • 4-Hydrazinylbenzoic acid Lamivudine  Impurity|CS-0229071
      619-67-0
    • ~82%
    • In-stock
      Ethyl 4-hydrazinylbenzoate hydrochloride|CS-0151753
      40566-85-6

    References

    • Cocquet, Guillaume; Ferroud, Clotilde; Guy, Alain Tetrahedron, 2000 , vol. 56, # 19 p. 2975 - 2984
  • Route3

    References

    • Street, Leslie J.; Baker, Raymond; Castro, Jose L.; Chambers, Mark S.; Guiblin, Alexander R.; et al. Journal of Medicinal Chemistry, 1993 , vol. 36, # 11 p. 1529 - 1538

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+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   64.35
  • LogP   1.5707
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   3

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