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CS-W001157 4
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Methyl 4-methyl-1H-imidazole-5-carboxylate

  • CAS No. 78892-68-9

  • Cat. No. CS-0567072
  • Purity≥98%
  • MDL No.None

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

Methyl 4-methyl-1H-imidazole-5-carboxylate|CS-0567072

Structure of 78892-68-9

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General Information

  • CAS No. 78892-68-9
  • Cat. No. CS-0567072
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₈N₂O₂
  • Molecular Weight 140.14
  • Synonym(s) Methyl 5-methyl-1H-imidazole-4-carboxylate
  • SMILES O=C(C1=C(C)N=CN1)OC

Synthesis

  • Route1

    References

    • SKandF Lab Co. Patent: US4328349 A1, 1982 ;
  • Route2

    References

    • Figueiredo, Juliana M.; Camara, Celso De A.; Amarante, Emanuel G.; Miranda, Ana Luisa P.; Santos, Fulvia M.; Rodrigues, Carlos R.; Fraga, Carlos Alberto M.; Barreiro, Eliezer J. Bioorganic and Medicinal Chemistry, 2000 , vol. 8, # 9 p. 2243 - 2248

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   54.98
  • LogP   0.50472
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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