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CS-W001157 4
Total: USD 88.00

1,4-Di(1H-imidazol-1-yl)butane

  • CAS No. 69506-86-1

  • Cat. No. CS-0110405
  • Purity≥98%
  • MDL No.MFCD00608317

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

1,4-Di(1H-imidazol-1-yl)butane|CS-0110405

Structure of 69506-86-1

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General Information

  • CAS No. 69506-86-1
  • Cat. No. CS-0110405
  • Purity ≥98%
  • MDL No. MFCD00608317
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₄N₄
  • Molecular Weight 190.25
  • Synonym(s) 1,4-Bis(imidazol-1-yl)-butane
  • SMILES N=1C=CN(C1)CCCCN2C=NC=C2

Description

1,4-Di(1H-imidazol-1-yl)butane features two imidazole moieties linked by a butane spacer, delivering a rigid yet flexible architecture ideal for coordination chemistry. The electron-rich imidazole rings enable robust metal binding, while the aliphatic chain provides tunable spatial separation. This bifunctional scaffold facilitates precise control in supramolecular assembly and catalytic framework design.

Application

1,4-Di(1H-imidazol-1-yl)butane serves as a versatile bifunctional ligand and building block in transition metal catalysis and heterocyclic synthesis. Its imidazole moieties provide strong coordination to metals while the butane spacer offers conformational flexibility and solubility. The compound enables efficient construction of N-heterocyclic frameworks and facilitates cross-coupling reactions under mild conditions, demonstrating robust bench stability and compatibility with standard purification protocols.

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-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   35.64
  • LogP   1.56
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   5

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