L-Histidinal

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Properties Simple | Detailed

Formula C6H9N3O
IUPAC Name (2s)-2-amino-3-imidazol-3-ium-4-ylium-4-yl-propanal
Molecular Mass 139.155 g·mol−1
Heat of Formation -21.2 ± 16.7 kJ·mol−1
Dipole Moment 4.49 ± 1.08 D
Volume 169.58 Å 3
Surface Area 170.79 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy 3.09 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-3-(3h-imidazol-4-yl)propanal
  • (2s)-2-amino-3-(3h-imidazol-4-yl)propionaldehyde
  • 1h-imidazole-4-propanal, alpha-amino-, (s)-
  • histidinaldehyde
  • l-histidinaldehyde
CAS Number(s)
  • 23784-15-8
InChIKey VYOIELONWKIZJS-YFKPBYRVSA-N
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