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CS-W001157 4
Total: USD 88.00

1,3-Di(1H-imidazol-1-yl)benzene

  • CAS No. 69506-91-8

  • Cat. No. CS-0110390
  • Purity≥98%
  • MDL No.MFCD23103199

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

1,3-Di(1H-imidazol-1-yl)benzene|CS-0110390

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General Information

  • CAS No. 69506-91-8
  • Cat. No. CS-0110390
  • Purity ≥98%
  • MDL No. MFCD23103199
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₀N₄
  • Molecular Weight 210.24
  • Synonym(s) 1,3-Bis(1H-imidazol-1-yl)benzene
  • SMILES N=1C=CN(C1)C2=CC=CC(=C2)N3C=NC=C3

Description

1,3-Di(1H-imidazol-1-yl)benzene features a rigid, electron-rich aromatic core with two imidazole moieties positioned at meta-locations. This configuration enables strong coordination to metal ions and facilitates supramolecular assembly through hydrogen bonding networks. The molecule exhibits enhanced stability under ambient conditions and demonstrates utility in catalysis and materials design.

Application

1,3-Di(1H-imidazol-1-yl)benzene serves as a versatile bifunctional building block in synthetic organic chemistry, enabling the construction of extended π-conjugated systems and metal-ligand architectures. Its imidazole moieties exhibit strong coordination to transition metals, facilitating catalyst design and materials applications. The compound demonstrates excellent bench stability, solubility in common organic solvents, and compatibility with standard coupling reactions, supporting efficient functionalization and purification in multi-step syntheses.

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

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Computational Chemistry Data

  • TPSA   35.64
  • LogP   2.058
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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