N-(3-Phenylpropanoyl)-L-Tyrosine

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Properties Simple | Detailed

Formula C18H19NO4
IUPAC Name (2s)-3-(4-hydroxyphenyl)-2-(3-phenylpropanoylamino)propanoic acid
Molecular Mass 313.348 g·mol−1
Heat of Formation -618.4 ± 16.7 kJ·mol−1
Dipole Moment 2.57 ± 1.08 D
Volume 389.38 Å 3
Surface Area 324.77 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy -0.15 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-3-(4-hydroxyphenyl)-2-(3-phenylpropanoylamino)propanoic acid
  • (2s)-3-(4-hydroxyphenyl)-2-(3-phenylpropanoylamino)propionic acid
  • (2s)-3-(4-hydroxyphenyl)-2-[(1-oxo-3-phenylpropyl)amino]propanoic acid
  • bplt-n(beta)
  • l-tyrosine, n-(1-oxo-3-phenylpropyl)-
  • n(beta)-phenylpropionyltyrosine
  • nbeta-phenylpropionyl-l-tyrosine
  • nbeta-phenylpropionyltyrosine
CAS Number(s)
  • 74717-57-0
InChIKey MCWLXSHTRCIDDZ-INIZCTEOSA-N
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