N-[(Benzyloxy)Carbonyl]-D-Phenylalanyl-L-Alanine

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Properties Simple | Detailed

Formula C20H22N2O5
IUPAC Name (2s)-2-[[(2r)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]propanoic acid
Molecular Mass 370.399 g·mol−1
Heat of Formation -764.5 ± 16.7 kJ·mol−1
Dipole Moment 2.86 ± 1.08 D
Volume 448.95 Å 3
Surface Area 397.55 Å 2
HOMO Energy -9.58 ± 0.55 eV
LUMO Energy -0.32 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2r)-1-oxo-2-[[oxo-(phenylmethoxy)methyl]amino]-3-phenylpropyl]amino]propanoic acid
  • (2s)-2-[[(2r)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]propionic acid
  • (2s)-2-[[(2r)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoic acid
InChIKey LEJTXQOVOPDGHS-WMLDXEAASA-N
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