6-[(4-Hydroxy-3-Nitrophenyl)Acetamido]Caproic Acid

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Properties Simple | Detailed

Formula C14H18N2O6
IUPAC Name 6-[[2-(4-hydroxy-3-nitro-phenyl)acetyl]amino]hexanoic acid
Molecular Mass 310.303 g·mol−1
Heat of Formation -800.4 ± 16.7 kJ·mol−1
Dipole Moment 4.74 ± 1.08 D
Volume 360.27 Å 3
Surface Area 342.55 Å 2
HOMO Energy -9.71 ± 0.55 eV
LUMO Energy -1.33 ± eV
Point Group Symmetry C1
Synonyms
  • 4-hydroxy-3-nitrophenylacetyl (np) caproic
  • 4-hydroxy-3-nitrophenylacetyl-epsilon-aminocaproic acid
  • 6-[2-(4-hydroxy-3-nitro-phenyl)ethanoylamino]hexanoic acid
  • 6-[[2-(4-hydroxy-3-nitrophenyl)-1-oxoethyl]amino]hexanoic acid
InChIKey XAYGJFACOIKJCT-UHFFFAOYSA-N
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