2,4,6-Trinitroanisol

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Properties Simple | Detailed

Formula C7H5N3O7
IUPAC Name 2-methoxy-1,3,5-trinitro-benzene
Molecular Mass 243.131 g·mol−1
Heat of Formation -66.3 ± 16.7 kJ·mol−1
Dipole Moment 3.41 ± 1.08 D
Volume 233.85 Å 3
Surface Area 224.87 Å 2
HOMO Energy -11.06 ± 0.55 eV
LUMO Energy 0.62 ± eV
Point Group Symmetry C1
Synonyms
  • 2,4,6-trinitroanisole
  • 2-methoxy-1,3,5-trinitrobenzene
  • anisole, 2,4,6-trinitro-
  • anisole, trinitro-
  • benzene, 2-methoxy-1,3,5-trinitro-
  • ether, methyl 2,4,6-trinitrophenyl
  • ether, methyl picryl
  • methyl picrate
  • trinitroanisole
  • trinitroanisole [un0213] [explosive 1.1d]
CAS Number(s)
  • 28653-16-9
  • 606-35-9
InChIKey FMXDVBRYDYFVGS-UHFFFAOYSA-N
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