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3-(3-(Prop-2-yn-1-yloxy)-2,2-bis((prop-2-yn-1-yloxy)methyl)propoxy)prop-1-yne

  • CAS No. 127751-08-0

  • Cat. No. CS-0646995
  • Purity≥97%
  • MDL No.MFCD10699962

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

3-(3-(Prop-2-yn-1-yloxy)-2,2-bis((prop-2-yn-1-yloxy)methyl)propoxy)prop-1-yne|CS-0646995

Structure of 127751-08-0

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General Information

  • CAS No. 127751-08-0
  • Cat. No. CS-0646995
  • Purity ≥97%
  • MDL No. MFCD10699962
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₂₀O₄
  • Molecular Weight None
  • Synonym(s) None
  • SMILES C#CCOCC(COCC#C)(COCC#C)COCC#C

Description

This propargylic ether features a highly functionalized alkyne-rich scaffold with multiple terminal acetylene groups. Designed for efficient coupling in click chemistry, the molecule integrates readily into bioconjugation workflows and supports modular assembly of complex molecular architectures under standard conditions.

Application

3-(3-(Prop-2-yn-1-yloxy)-2,2-bis((prop-2-yn-1-yloxy)methyl)propoxy)prop-1-yne serves as a versatile, multi-functional building block for the construction of complex polyether architectures. Its terminal alkyne groups enable efficient copper-catalyzed azide-alkyne cycloaddition (CuAAC), while the hydroxyl-directed propargylation pattern provides orthogonal reactivity and enhanced solubility. The molecule exhibits excellent bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis in medicinal chemistry and materials science applications.

Safety Information

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GHS Pictogram : N/A
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Signal Word : N/A
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Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   36.92
  • LogP   0.572
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   12

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