N-Methyl-L-Histidine

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Properties Simple | Detailed

Formula C7H11N3O2
IUPAC Name (2s)-3-(1h-imidazol-5-yl)-2-(methylamino)propanoic acid
Molecular Mass 169.181 g·mol−1
Heat of Formation -261.9 ± 16.7 kJ·mol−1
Dipole Moment 3.77 ± 1.08 D
Volume 202.49 Å 3
Surface Area 197.96 Å 2
HOMO Energy -9.36 ± 0.55 eV
LUMO Energy 3.51 ± eV
Point Group Symmetry C1
Synonyms
  • 7
  • 9
  • c
  • i
  • n
  • z
CAS Number(s)
  • 24886-03-1
InChIKey CYZKJBZEIFWZSR-LURJTMIESA-N
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