3,4-Dimethoxyphenylacetonitirle

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Properties Simple | Detailed

Formula C10H11NO2
IUPAC Name 2-(3,4-dimethoxyphenyl)acetonitrile
Molecular Mass 177.200 g·mol−1
Heat of Formation -113.2 ± 16.7 kJ·mol−1
Dipole Moment 4.00 ± 1.08 D
Volume 222.82 Å 3
Surface Area 216.3 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -0.28 ± eV
Point Group Symmetry C1
Synonyms
  • (3,4-dimethoxyphenyl)acetonitrile
  • 2-(3,4-dimethoxyphenyl)ethanenitrile
  • 3,4-(dimethoxyphenyl)acetonitrile
  • 3,4-dimethoxybenzeneacetonitrile
  • 3,4-dimethoxybenzyl cyanide
  • 3,4-dimethoxybenzylcyanide
  • 3,4-dimethoxyphenylacetonitrile
  • 3,4-dimethylbenzyl cyanide
  • acetonitrile, (3,4-dimethoxyphenyl)-
  • acetonitrile, 3,4-(dimethoxyphenyl)-
  • acetonitrile, 3,4-dimethoxyphenyl-
  • benzeneacetonitrile, 3,4-dimethoxy-
  • benzeneacetonitrile, 3,4-dimethoxy- (9ci)
  • homoveratronitrile
  • iflab1_000888
  • oprea1_832287
  • veratryl cyanide
CAS Number(s)
  • 93-17-4
InChIKey ASLSUMISAQDOOB-UHFFFAOYSA-N
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