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CS-W001157 4
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3-Ethyloxetane-3-carbaldehyde

  • CAS No. 98485-37-1

  • Cat. No. CS-0183630
  • Purity≥97%
  • MDL No.None

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

3-Ethyloxetane-3-carbaldehyde|CS-0183630

Structure of 98485-37-1

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General Information

  • CAS No. 98485-37-1
  • Cat. No. CS-0183630
  • Purity ≥97%
  • MDL No. None
  • Storage -20°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₀O₂
  • Molecular Weight 114.14
  • Synonym(s) 3-Ethyl-3-oxetanecarboxaldehyde
  • SMILES CCC1(C=O)COC1

Description

3-Ethyloxetane-3-carbaldehyde is a bench-stable, moisture-tolerant heterocyclic aldehyde featuring a strained oxetane ring fused to an ethyl-substituted carbonyl group. This unique structural motif enables direct incorporation into complex molecular architectures via nucleophilic addition or cycloaddition reactions. The aldehyde functionality provides a reactive handle for conjugation with amines or hydrazides, facilitating the synthesis of bioconjugates and functionalized polymers under mild conditions.

Application

3-Ethyloxetane-3-carbaldehyde serves as a versatile synthon in medicinal chemistry, enabling efficient access to oxetane-containing scaffolds via [3+2] cycloadditions and nucleophilic additions. Its aldehyde functionality facilitates direct functionalization or conversion to imines and hydrazones, while the strained oxetane ring enhances metabolic stability and solubility in drug candidates. The molecule exhibits good bench stability and compatibility with common protecting groups, supporting straightforward purification and integration into multi-step synthesis workflows.

Synthesis

  • Route1

    References

    • Smith, Ian H.; Budd, Timothy C.; Sills, Jill; Casida, John E. Journal of Agricultural and Food Chemistry, 1993 , vol. 41, # 7 p. 1114 - 1117

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
Precautionary Statements : P264-P270-P330-P501

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   0.6119
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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