5-Methyl-2,3,4-Trinitrophenol

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Properties Simple | Detailed

Formula C7H5N3O7
IUPAC Name 5-methyl-2,3,4-trinitro-phenol
Molecular Mass 243.130 g·mol−1
Heat of Formation -83.6 ± 16.7 kJ·mol−1
Dipole Moment 7.07 ± 1.08 D
Volume 237.79 Å 3
Surface Area 220.22 Å 2
HOMO Energy -11.07 ± 0.55 eV
LUMO Energy -2.12 ± eV
Point Group Symmetry Cs
Synonyms
  • methyltrinitrophenol
  • trinitrocresolate
CAS Number(s)
  • 28905-71-7
InChIKey VIGWOECDNBSOGQ-UHFFFAOYSA-N
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