(4-Hydroxy-3,5-Dinitrophenyl)Acetic Acid

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Properties Simple | Detailed

Formula C8H6N2O7
IUPAC Name 2-(4-hydroxy-3,5-dinitro-phenyl)acetic acid
Molecular Mass 242.142 g·mol−1
Heat of Formation -518.0 ± 16.7 kJ·mol−1
Dipole Moment 5.25 ± 1.08 D
Volume 240.67 Å 3
Surface Area 229.77 Å 2
HOMO Energy -10.57 ± 0.55 eV
LUMO Energy 0.78 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(4-hydroxy-3,5-dinitro-phenyl)ethanoic acid
  • 2-(4-hydroxy-3,5-dinitrophenyl)acetic acid
  • 3,5-dinitro-4-hydroxyphenacetic acid
  • 3,5-dinitro-4-hydroxyphenyl-acetic acid
  • 4-hydroxy-3,5-dinitrobenzeneacetic acid
  • 4-hydroxy-3,5-dinitrophenacetyl
CAS Number(s)
  • 10463-37-3
InChIKey MLVYQQLUGFSXQH-UHFFFAOYSA-N
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