Boc-L-His(Bom)-Oh

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Properties Simple | Detailed

Formula C19H26N3O5
IUPAC Name (2s)-3-[3-(benzyloxymethyl)-4h-imidazol-1-ium-4-id-5-yl]-2-(tert-butoxycarbonylamino)propanoic acid
Molecular Mass 376.427 g·mol−1
Heat of Formation -799.6 ± 16.7 kJ·mol−1
Dipole Moment 7.49 ± 1.08 D
Volume 465.77 Å 3
Surface Area 361.62 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy -0.05 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-(tert-butoxycarbonylamino)-3-[1-(phenylmethoxymethyl)imidazol-4-yl]propanoic acid
  • (2s)-2-[(tert-butoxy-oxomethyl)amino]-3-[1-(phenylmethoxymethyl)-4-imidazolyl]propanoic acid
  • (2s)-3-[1-(benzyloxymethyl)imidazol-4-yl]-2-(tert-butoxycarbonylamino)propionic acid
InChIKey IEAOAWZLUGOPJX-INIZCTEOSA-N
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