N-(2,4-Dinitrophenyl)-β-Alanylglycylglycine

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Properties Simple | Detailed

Formula C13H15N5O8
IUPAC Name 2-[[2-[3-(2,4-dinitroanilino)propanoylamino]acetyl]amino]acetic acid
Molecular Mass 369.287 g·mol−1
Heat of Formation -712.7 ± 16.7 kJ·mol−1
Dipole Moment 11.24 ± 1.08 D
Volume 403.49 Å 3
Surface Area 347.33 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy -1.37 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[2-[3-[(2,4-dinitrophenyl)amino]propanoylamino]ethanoylamino]ethanoic acid
  • 2-[[2-[3-[(2,4-dinitrophenyl)amino]propanoylamino]acetyl]amino]acetic acid
  • 2-[[2-[[3-[(2,4-dinitrophenyl)amino]-1-oxopropyl]amino]-1-oxoethyl]amino]acetic acid
  • dinitrophenyl-beta-ala-gly-gly
  • dinitrophenyl-beta-alanyl-glycyl-glycine
  • dinitrophenyl-beta-alanylglycylglycine
  • dnp-ala-gly-gly
CAS Number(s)
  • 39555-56-1
InChIKey CPJBFJHFOFDTMB-UHFFFAOYSA-N
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