2-Iodotoluene

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Properties Simple | Detailed

Formula C7H7I
IUPAC Name 1-iodo-2-methyl-benzene
Molecular Mass 218.035 g·mol−1
Heat of Formation 123.8 ± 16.7 kJ·mol−1
Dipole Moment 2.10 ± 1.08 D
Volume 166.42 Å 3
Surface Area 166.35 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -0.47 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-iodo-2-methylbenzene
  • 2-iodobenzyl group
  • 2ib
  • benzene, 1-iodo-2-methyl-
  • cbiol_000851
  • iccb4_000147
  • o-iodotoluene
  • o-methyliodobenzene
  • o-tolyl iodide
  • toluene, o-iodo-
  • toluene, o-iodo- (8ci)
CAS Number(s)
  • 615-37-2
InChIKey RINOYHWVBUKAQE-UHFFFAOYSA-N
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