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CS-W001157 4
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3-Ethyloxetane-3-carboxylic acid

  • CAS No. 28562-61-0

  • Cat. No. CS-0051378
  • Purity≥96%
  • MDL No.MFCD12024538

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

3-Ethyloxetane-3-carboxylic acid|CS-0051378

Structure of 28562-61-0

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General Information

  • CAS No. 28562-61-0
  • Cat. No. CS-0051378
  • Purity ≥96%
  • MDL No. MFCD12024538
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₀O₃
  • Molecular Weight 130.14
  • Synonym(s) 3-Ethyl-3-oxetanecarboxylic acid
  • SMILES CCC1(COC1)C(O)=O

Description

3-Ethyloxetane-3-carboxylic acid features a strained oxetane ring fused to a carboxylic acid group, enabling high reactivity in bioorthogonal conjugation. The ethyl substituent enhances solubility and stability under physiological conditions. This scaffold integrates readily into peptide and polymer architectures, offering efficient coupling without catalysts.

Application

3-Ethyloxetane-3-carboxylic acid serves as a valuable building block in medicinal chemistry, enabling the synthesis of oxetane-containing scaffolds with enhanced metabolic stability and improved solubility. Its carboxylic acid functionality facilitates direct derivatization via esterification or amide coupling, while the strained oxetane ring provides a robust platform for C–C bond formation. The compound exhibits good bench stability and is compatible with standard reaction conditions, supporting efficient incorporation into complex molecular architectures.

Synthesis

  • Route1

    References

    • Journal of Polymer Science, Part A: Polymer Chemistry, , vol. 50, # 3 p. 458 - 465

Safety Information

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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

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   0.4976
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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