1H-Imidazole-1-Ethanol, 4-((2-Aminoethyl)Thio)-2-Methyl-

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Properties Simple | Detailed

Formula C8H15N3OS
IUPAC Name 2-[4-(2-aminoethylsulfanyl)-2-methyl-imidazol-1-ium-2-ylium-1-yl]ethanol
Molecular Mass 201.289 g·mol−1
Heat of Formation -81.7 ± 16.7 kJ·mol−1
Dipole Moment 6.61 ± 1.08 D
Volume 248.38 Å 3
Surface Area 242.2 Å 2
HOMO Energy -7.84 ± 0.55 eV
LUMO Energy 0.42 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-(2-aminoethylsulfanyl)-2-methyl-imidazol-1-yl]ethanol
  • 2-[4-(2-aminoethylsulfanyl)-2-methylimidazol-1-yl]ethanol
  • 2-[4-(2-aminoethylthio)-2-methyl-1-imidazolyl]ethanol
  • 2-[4-(2-aminoethylthio)-2-methyl-imidazol-1-yl]ethanol
  • 4-(2-aminoethyl)thio-2-methylimidazole-1-ethanol
  • 4-atme
CAS Number(s)
  • 78949-89-0
InChIKey ZPFOMYNSYLEOTB-UHFFFAOYSA-N
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