2-Amino-4,6-Dinitrotoluene

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Properties Simple | Detailed

Formula C7H7N3O4
IUPAC Name 2-methyl-3,5-dinitro-aniline
Molecular Mass 197.148 g·mol−1
Heat of Formation 37.8 ± 16.7 kJ·mol−1
Dipole Moment 7.19 ± 1.08 D
Volume 204.85 Å 3
Surface Area 199.9 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy -1.86 ± eV
Point Group Symmetry C1
Synonyms
  • (2-methyl-3,5-dinitro-phenyl)amine
  • 2-amino-1-methyl-4,6-dinitrobenzene
  • 2-methyl-3,5-dinitro-phenylamine
  • 2-methyl-3,5-dinitroaniline
  • 2-methyl-3,5-dinitrobenzenamine
  • 3,5-dinitro-o-toluidine
  • bas 00615829
  • benzenamine, 2-methyl-3,5-dinitro-
  • benzenamine, 3,5-dinitro-2-methyl- (9ci)
  • o-toluidine, 3,5-dinitro-
  • zero/001257
CAS Number(s)
  • 35572-78-2
InChIKey IEEJAAUSLQCGJH-UHFFFAOYSA-N
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