N-{6-[(2,4-Dinitrophenyl)Amino]Hexanoyl}-L-Tyrosine

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Properties Simple | Detailed

Formula C21H24N4O8
IUPAC Name (2s)-2-[6-(2,4-dinitroanilino)hexanoylamino]-3-(4-hydroxyphenyl)propanoic acid
Molecular Mass 460.437 g·mol−1
Heat of Formation -715.1 ± 16.7 kJ·mol−1
Dipole Moment 9.84 ± 1.08 D
Volume 534.31 Å 3
Surface Area 468.36 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -1.48 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[6-[(2,4-dinitrophenyl)amino]hexanoylamino]-3-(4-hydroxyphenyl)propanoic acid
  • (2s)-2-[6-[(2,4-dinitrophenyl)amino]hexanoylamino]-3-(4-hydroxyphenyl)propionic acid
  • (2s)-2-[[6-[(2,4-dinitrophenyl)amino]-1-oxohexyl]amino]-3-(4-hydroxyphenyl)propanoic acid
  • 2,4-dinitrophenylaminocaproyl-l-tyrosine
  • 2,4-dinitrophenylaminocaproyltyrosine
  • dnp-ac-tyr
  • l-tyrosine, n-(6-((2,4-dinitrophenyl)amino)-1-oxohexyl)-
CAS Number(s)
  • 104077-24-9
InChIKey JUCODPLCOTZQPD-SFHVURJKSA-N
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