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CS-W001157 4
Total: USD 88.00

1-(1-Methyl-1H-imidazol-2-yl)ethanone

  • CAS No. 85692-37-1

  • Cat. No. CS-W005322
  • Purity≥97%
  • MDL No.MFCD08668178

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

1-(1-Methyl-1H-imidazol-2-yl)ethanone|CS-W005322

Structure of 85692-37-1

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General Information

  • CAS No. 85692-37-1
  • Cat. No. CS-W005322
  • Purity ≥97%
  • MDL No. MFCD08668178
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₈N₂O
  • Molecular Weight 124.14
  • Synonym(s) Ethanone, 1-(1-methyl-1H-imidazol-2-yl)- (9CI)
  • SMILES CN1C=CN=C1C(C)=O

Synthesis

  • Route1
    • In-stock
      1-Methylimidazole|CS-W008580
      616-47-7
    • null|null
      141-78-6
    • ~77%
    • In-stock
      1-(1-Methyl-1H-imidazol-2-yl)ethanone|CS-W005322
      85692-37-1

    References

    • Willemsen, Jorgen S.; Megens, Rik P.; Roelfes, Gerard; Van Hest, Jan C. M.; Rutjes, Floris P. J. T. European Journal of Organic Chemistry, 2014 , vol. 2014, # 14 p. 2892 - 2898
  • Route2

    References

    • Wang, Jocelyn; Benedetti, Erica; Bethge, Lucas; Vonhoff, Stefan; Klussmann, Sven; Vasseur, Jean-Jacques; Cossy, Janine; Smietana, Michael; Arseniyadis, Stellios Angewandte Chemie - International Edition, 2013 , vol. 52, # 44 p. 11546 - 11549 Angew. Chem., 2013 , vol. 125, # 44 p. 11760 - 11763
  • Route3
    • 1-(1-Methylimidazol-2-yl)ethanol|CS-0183539
      41507-36-2
    • ~84%
    • In-stock
      1-(1-Methyl-1H-imidazol-2-yl)ethanone|CS-W005322
      85692-37-1

    References

    • Khazan, Minoo; Hadizadeh, Farzin; Shafiee, Abbas Journal of Heterocyclic Chemistry, 1997 , vol. 34, # 5 p. 1543 - 1547

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

Quality Control

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Computational Chemistry Data

  • TPSA   34.89
  • LogP   0.6227
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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