3,4-Dimethoxybenzonitrile

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Properties Simple | Detailed

Formula C9H9NO2
IUPAC Name 3,4-dimethoxybenzonitrile
Molecular Mass 163.173 g·mol−1
Heat of Formation -85.1 ± 16.7 kJ·mol−1
Dipole Moment 4.90 ± 1.08 D
Volume 200.14 Å 3
Surface Area 197.87 Å 2
HOMO Energy -9.70 ± 0.55 eV
LUMO Energy 2.13 ± eV
Point Group Symmetry C1
Synonyms
  • 3,4-dimethoxybenzoic acid nitrile
  • ap-065/41884102
  • benzonitrile, 3,4-dimethoxy-
  • veratronitrile
CAS Number(s)
  • 23024-83-1
  • 2024-83-1
InChIKey OSEQIDSFSBWXRE-UHFFFAOYSA-N
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