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CS-W001157 4
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Methyl 1H-imidazole-2-carboxylate

  • CAS No. 17334-09-7

  • Cat. No. CS-W005714
  • Purity≥97%
  • MDL No.None

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

Methyl 1H-imidazole-2-carboxylate|CS-W005714

Structure of 17334-09-7

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General Information

  • CAS No. 17334-09-7
  • Cat. No. CS-W005714
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₆N₂O₂
  • Molecular Weight 126.11
  • Synonym(s) Methyl imidazole-2-carboxylate
  • SMILES O=C(C1=NC=CN1)OC

Description

Methyl 1H-imidazole-2-carboxylate is a bench-stable, moisture-tolerant heterocyclic ester featuring a nitrogen-rich imidazole core. This compound integrates readily into synthetic sequences requiring electron-deficient aromatic scaffolds. It serves as a direct precursor for C2-functionalized imidazoles and facilitates coupling reactions under mild conditions.

Application

Methyl 1H-imidazole-2-carboxylate serves as a versatile building block in heterocyclic synthesis, enabling efficient access to imidazole-containing scaffolds via nucleophilic substitution or transition-metal-catalyzed coupling. Its methyl ester functionality offers facile manipulation for further derivatization, while the imidazole core provides robust stability and compatibility with diverse reaction conditions. This compound functions effectively in medicinal chemistry and materials science applications where functionalized imidazoles are required.

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   0.1963
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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