2-Nitrotoluene

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Properties Simple | Detailed

Formula C7H7NO2
IUPAC Name 1-methyl-2-nitro-benzene
Molecular Mass 137.136 g·mol−1
Heat of Formation 37.1 ± 16.7 kJ·mol−1
Dipole Moment 4.79 ± 1.08 D
Volume 158.48 Å 3
Surface Area 161.41 Å 2
HOMO Energy -10.26 ± 0.55 eV
LUMO Energy 1.81 ± eV
Point Group Symmetry C1
Synonyms
  • 1-methyl-2-nitrobenzene
  • 2-methyl-1-nitrobenzene
  • 2-methylnitrobenzene
  • 2-nitrotoluol
  • benzene, 1-methyl-2-nitro-
  • nitrotoluene, all isomers
  • nitrotoluene, o-
  • nitrotoluene, o-isomer
  • o-methylnitrobenzene
  • o-nitrotoluene
  • o-nitrotoluene, liquid [un1664] [poison]
  • o-nitrotoluol
  • ont
  • ortho-nitrotoluol
  • toluene, o-nitro-
  • toluene,2-nitro
CAS Number(s)
  • 88-72-2
  • 57158-05-1
InChIKey PLAZTCDQAHEYBI-UHFFFAOYSA-N
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