L-2-Fluorohistidine

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Properties Simple | Detailed

Formula C6H8FN3O2
IUPAC Name (2s)-2-amino-3-(2-fluoroimidazol-3-ium-4-ylium-4-yl)propanoic acid
Molecular Mass 173.145 g·mol−1
Heat of Formation -422.9 ± 16.7 kJ·mol−1
Dipole Moment 4.73 ± 1.08 D
Volume 187.96 Å 3
Surface Area 188.38 Å 2
HOMO Energy -9.61 ± 0.55 eV
LUMO Energy 0.05 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-3-(2-fluoro-3h-imidazol-4-yl)propanoic acid
  • (2s)-2-amino-3-(2-fluoro-3h-imidazol-4-yl)propionic acid
  • cbiol_001035
  • iccb4_000331
InChIKey OYHWICVZBUWSBK-BYPYZUCNSA-N
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