4-Nitrophenyl N-{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-L-Tyrosinate

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Formula C20H22N2O7
IUPAC Name (4-nitrophenyl) (2s)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoate
Molecular Mass 402.398 g·mol−1
Heat of Formation -840.1 ± 16.7 kJ·mol−1
Dipole Moment 5.69 ± 1.08 D
Volume 466.24 Å 3
Surface Area 390.18 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy -1.25 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propionic acid (4-nitrophenyl) ester
  • (2s)-2-[(tert-butoxy-oxomethyl)amino]-3-(4-hydroxyphenyl)propanoic acid (4-nitrophenyl) ester
  • (4-nitrophenyl) (2s)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoate
InChIKey BNBKZMYOTFMWHX-KRWDZBQOSA-N
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