N-Benzoyl-3-Nitro-L-Tyrosine

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Properties Simple | Detailed

Formula C16H14N2O6
IUPAC Name (2s)-2-benzamido-3-(4-hydroxy-3-nitro-phenyl)propanoic acid
Molecular Mass 330.292 g·mol−1
Heat of Formation -602.1 ± 16.7 kJ·mol−1
Dipole Moment 3.33 ± 1.08 D
Volume 370.56 Å 3
Surface Area 315.15 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy 1.56 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-(benzoylamino)-3-(4-hydroxy-3-nitro-phenyl)propanoic acid
  • (2s)-2-(benzoylamino)-3-(4-hydroxy-3-nitro-phenyl)propionic acid
  • (2s)-2-(benzoylamino)-3-(4-hydroxy-3-nitrophenyl)propanoic acid
  • (2s)-3-(4-hydroxy-3-nitro-phenyl)-2-(phenylcarbonylamino)propanoic acid
  • (2s)-3-(4-hydroxy-3-nitrophenyl)-2-[(oxo-phenylmethyl)amino]propanoic acid
  • 1-nitrohydroxyphenyl-n-benzoylalanine
  • gal 1
  • gal-1
CAS Number(s)
  • 59921-69-6
InChIKey CYNAPIVXKRLDER-LBPRGKRZSA-N
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