2-Hydroxyamino-4,6-Dinitrotoluene

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Properties Simple | Detailed

Formula C7H7N3O5
IUPAC Name n-(2-methyl-3,5-dinitro-phenyl)hydroxylamine
Molecular Mass 213.148 g·mol−1
Heat of Formation -18.8 ± 16.7 kJ·mol−1
Dipole Moment 5.60 ± 1.08 D
Volume 220.11 Å 3
Surface Area 211.65 Å 2
HOMO Energy -10.18 ± 0.55 eV
LUMO Energy -2.27 ± eV
Point Group Symmetry C1
Synonyms
  • 2-hydroxyamino-1-methyl-4,6-dinitrobenzene
  • 2-hydroxylamino-1-methyl-4,6-dinitrobenzene
  • 2-hydroxylamino-4,6-dinitrotoluene
  • benzenamine, n-hydroxy-2-methyl-3,5-dinitro-
  • n-(2-methyl-3,5-dinitro-phenyl)hydroxylamine
  • n-(2-methyl-3,5-dinitrophenyl)hydroxylamine
CAS Number(s)
  • 59283-76-0
InChIKey KONVLHWTMAMGAA-UHFFFAOYSA-N
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