1,4-Methyl-Imidazoleacetic Acid

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Properties Simple | Detailed

Formula C6H8N2O2
IUPAC Name 2-(3-methyl-4h-imidazol-3-ium-4-ylium-5-yl)acetic acid
Molecular Mass 140.140 g·mol−1
Heat of Formation -264.7 ± 16.7 kJ·mol−1
Dipole Moment 4.57 ± 1.08 D
Volume 166.96 Å 3
Surface Area 173.06 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy 0.54 ± eV
Point Group Symmetry C1
Synonyms
  • 1-methyl-4-imidazoleacetate
  • 1-methyl-4-imidazoleacetic acid
  • 1-methylimidazole-4-acetate
  • 1h-imidazole-4-acetic acid, 1-methyl-
  • 2-(1-methyl-4-imidazolyl)acetic acid
  • 2-(1-methylimidazol-4-yl)acetic acid
  • 2-(1-methylimidazol-4-yl)ethanoic acid
  • methylimidazoleacetate
  • methylimidazoleacetic acid
  • tele-methylimidazoleacetic acid
CAS Number(s)
  • 2625-49-2
  • 35454-39-8
InChIKey ZHCKPJGJQOPTLB-UHFFFAOYSA-N
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