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CS-W001157 4
Total: USD 88.00

1-Methylimidazole

  • CAS No. 616-47-7

  • Cat. No. CS-W008580
  • Purity≥98%
  • MDL No.MFCD00005292

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

1-Methylimidazole|CS-W008580

Structure of 616-47-7

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General Information

  • CAS No. 616-47-7
  • Cat. No. CS-W008580
  • Purity ≥98%
  • MDL No. MFCD00005292
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₆N₂
  • Molecular Weight 82.10
  • Synonym(s) None
  • SMILES CN1C=CN=C1

Application

1-Methylimidazole serves as a versatile, bench-stable nitrogen heterocycle widely employed in transition metal catalysis and organic synthesis. Its moderate basicity and strong coordination ability make it an effective ligand in palladium-catalyzed cross-coupling reactions and a useful additive in C–H functionalization processes. The molecule exhibits excellent solubility in common organic solvents and demonstrates robust functional group tolerance, facilitating straightforward purification and integration into multi-step synthetic sequences.

Synthesis

  • Route1

    References

    • KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY Patent: WO2008/1985 A1, 2008 ; Location in patent: Page/Page column 11 ;
  • Route2

    References

    • Tetrahedron Letters, , vol. 54, # 26 p. 3384 - 3387
  • Route3
    • Imidazole Ondansetron Impurity|CS-0229601
      288-32-4
    • null|null
      616-38-6
    • ~95%
    • In-stock
      1-Methylimidazole|CS-W008580
      616-47-7

    References

    • Borredon, Elisabeth; Chabaud, Berhard; Gaset, Antoine; Thiebaud-Roux, Sophie; Ouk, Samedy Patent: US2004/24205 A1, 2004 ; Location in patent: Page 2 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS06
Signal Word : Danger
UN#: 2922
Class : 8 (6.1)
Packing Group : Ⅱ
Hazard Statements : H227-H302-H311-H314
Precautionary Statements : P210-P260-P264-P270-P280-P301+P330+P331-P302+P352-P304+P340-P330-P361+P364-P363-P370+P378-P403-P405-P501

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Computational Chemistry Data

  • TPSA   17.82
  • LogP   0.4201
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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