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CS-W001157 4
Total: USD 88.00

1,3-Dimethyl-1H-imidazol-3-ium chloride

  • CAS No. 79917-88-7

  • Cat. No. CS-W011086
  • Purity≥97%
  • MDL No.MFCD08276366

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

1,3-Dimethyl-1H-imidazol-3-ium chloride|CS-W011086

Structure of 79917-88-7

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General Information

  • CAS No. 79917-88-7
  • Cat. No. CS-W011086
  • Purity ≥97%
  • MDL No. MFCD08276366
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₉ClN₂
  • Molecular Weight 132.59
  • Synonym(s) 1,3-Dimethylimidazolium Chloride
  • SMILES C[N+]1=CN(C)C=C1.[Cl-]

Description

1,3-Dimethyl-1H-imidazol-3-ium chloride is a bench-stable ionic compound featuring a charged imidazolium core with methyl groups at the 1- and 3-positions. This structure confers enhanced solubility in polar solvents and stability under ambient conditions, making it suitable for use as a building block in catalysis, materials chemistry, and ionic liquid formulations.

Application

1,3-Dimethyl-1H-imidazol-3-ium chloride serves as a stable, bench-friendly building block for the synthesis of imidazolium-based ionic liquids and catalytic systems. Its well-defined cationic character enables straightforward salt metathesis and functionalization, supporting applications in organocatalysis, electrochemistry, and asymmetric synthesis. The compound exhibits excellent solubility in polar solvents and tolerance to common functional groups, facilitating purification and integration into multi-step synthetic sequences.

Synthesis

  • Route1

    References

    • Alcalde, Ermitas; Dinares, Immaculada; Ibanez, Anna; Mesquida, Neus Molecules, 2012 , vol. 17, # 4 p. 4007 - 4027
  • Route2
    • null|null
      39678-28-9
    • null|null
      74-89-5
    • ~72%
    • In-stock
      1,3-Dimethyl-1H-imidazol-3-ium chloride|CS-W011086
      79917-88-7

    References

    • Zhao, Sanhu; Xu, Xiaoming; Zheng, Lu; Liu, Hai Ultrasonics Sonochemistry, 2010 , vol. 17, # 4 p. 685 - 689
  • Route3
    • null|null
      74-87-3
    • null|null
      18156-74-6
    • ~39%
    • In-stock
      1,3-Dimethyl-1H-imidazol-3-ium chloride|CS-W011086
      79917-88-7

    References

    • Harlow, Karsten J.; Hill, Anthony F.; Welton, Tom Synthesis, 1996 , # 6 p. 697 - 698

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-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   8.81
  • LogP   -3.1464
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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