2,6-Dinitro-3-Pyridinyl Acetate

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Properties Simple | Detailed

Formula C7H5N3O6
IUPAC Name (2,6-dinitro-3-pyridyl) acetate
Molecular Mass 227.131 g·mol−1
Heat of Formation -179.9 ± 16.7 kJ·mol−1
Dipole Moment 7.53 ± 1.08 D
Volume 226.07 Å 3
Surface Area 220.83 Å 2
HOMO Energy -10.99 ± 0.55 eV
LUMO Energy 0.83 ± eV
Point Group Symmetry C1
Synonyms
  • (2,6-dinitropyridin-3-yl) acetate
  • (2,6-dinitropyridin-3-yl) ethanoate
  • 3-acetoxy-2,6-dinitropyridine
  • 3-pyridinol, 2,6-dinitro-, acetate (ester)
  • acetic acid (2,6-dinitro-3-pyridyl) ester
CAS Number(s)
  • 35666-27-4
InChIKey ORBRXVAYODLQOU-UHFFFAOYSA-N
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