Pi-Methylimidazoleacetic Acid

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Properties Simple | Detailed

Formula C6H8N2O2
IUPAC Name 2-(3-methylimidazol-3-ium-4-ylium-4-yl)acetic acid
Molecular Mass 140.140 g·mol−1
Heat of Formation -270.2 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 166.97 Å 3
Surface Area 167.49 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy 0.02 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-imidazole-5-acetic acid, 1-methyl-
  • 2-(3-methyl-4-imidazolyl)acetic acid
  • 2-(3-methylimidazol-4-yl)acetic acid
  • 2-(3-methylimidazol-4-yl)ethanoic acid
  • p-miaa
  • pros-methylimidazoleacetic acid
CAS Number(s)
  • 4200-48-0
InChIKey UJCGYTCAMOHYCG-UHFFFAOYSA-N
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