[(R)-{[(Benzyloxy)Carbonyl]Amino}(4-Carbamimidoylphenyl)Methyl]Phosphonic Acid

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Properties Simple | Detailed

Formula C16H18N3O5P
IUPAC Name [(r)-benzyloxycarbonylamino-(4-carbamimidoylphenyl)methyl]phosphonic acid
Molecular Mass 363.305 g·mol−1
Heat of Formation -892.7 ± 16.7 kJ·mol−1
Dipole Moment 4.09 ± 1.08 D
Volume 405.1 Å 3
Surface Area 369.01 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy -0.68 ± eV
Point Group Symmetry C1
Synonyms
  • [(r)-(4-amidinophenyl)-(benzyloxycarbonylamino)methyl]phosphonic acid
  • [(r)-(4-carbamimidoylphenyl)-(phenylmethoxycarbonylamino)methyl]phosphonic acid
  • [(r)-(4-carbamimidoylphenyl)-[[oxo-(phenylmethoxy)methyl]amino]methyl]phosphonic acid
  • [n-(benzyloxycarbonyl)amino](4-amidinophenyl)methane-phosphonate
  • z-amidinophenylmethane-phosphonate
  • zap
InChIKey FSNDLCSOLUMYRH-OAHLLOKOSA-N
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