2,6-Dimethylbenzonitrile

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Properties Simple | Detailed

Formula C9H9N
IUPAC Name 2,6-dimethylbenzonitrile
Molecular Mass 131.174 g·mol−1
Heat of Formation 139.4 ± 16.7 kJ·mol−1
Dipole Moment 3.70 ± 1.08 D
Volume 175.96 Å 3
Surface Area 175.48 Å 2
HOMO Energy -9.80 ± 0.55 eV
LUMO Energy 2.39 ± eV
Point Group Symmetry Cs
Synonyms
  • benzonitrile, 2,6-dimethyl-
CAS Number(s)
  • 6575-13-9
InChIKey QSACPWSIIRFHHR-UHFFFAOYSA-N
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Elements H C N