Ethyl 1H-Imidazole-4-Carboxylate

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Properties Simple | Detailed

Formula C6H8N2O2
IUPAC Name ethyl imidazol-3-ium-4-ylium-4-carboxylate
Molecular Mass 140.140 g·mol−1
Heat of Formation -239.9 ± 16.7 kJ·mol−1
Dipole Moment 5.29 ± 1.08 D
Volume 166.72 Å 3
Surface Area 174.04 Å 2
HOMO Energy -10.01 ± 0.55 eV
LUMO Energy 2.51 ± eV
Point Group Symmetry Cs
Synonyms
  • 1h-imidazole-4-carboxylic acid ethyl ester
  • 1h-imidazole-4-carboxylic acid, ethyl ester
  • 3h-imidazole-4-carboxylic acid ethyl ester
  • c 751
  • c-751
  • ethyl 1h-imidazole-5-carboxylate
  • ethyl 3h-imidazole-4-carboxylate
  • ethyl 4(5)-imidazolecarboxylate
  • imidazole-5-carboxylic acid, ethyl ester
CAS Number(s)
  • 23785-21-9
InChIKey KLWYPRNPRNPORS-UHFFFAOYSA-N
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