N-(3,5-Dinitrobenzoyl)-L-Tyrosine

Molecule SVG Image

Properties Simple | Detailed

Formula C16H13N3O8
IUPAC Name (2s)-2-[(3,5-dinitrobenzoyl)amino]-3-(4-hydroxyphenyl)propanoic acid
Molecular Mass 375.290 g·mol−1
Heat of Formation -581.7 ± 16.7 kJ·mol−1
Dipole Moment 4.90 ± 1.08 D
Volume 404.41 Å 3
Surface Area 337.66 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy 0.78 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[(3,5-dinitrobenzoyl)amino]-3-(4-hydroxyphenyl)propionic acid
  • (2s)-2-[(3,5-dinitrophenyl)carbonylamino]-3-(4-hydroxyphenyl)propanoic acid
  • (2s)-2-[[(3,5-dinitrophenyl)-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid
  • dnb-tyr
  • l-tyrosine, n-(3,5-dinitrobenzoyl)-
  • n-(3,5-dinitrobenzoyl)tyrosine
CAS Number(s)
  • 86091-65-8
InChIKey DCSVEDZIOSFADB-AWEZNQCLSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N