3,3-Dimethoxypropanenitrile

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Properties Simple | Detailed

Formula C5H9NO2
IUPAC Name 3,3-dimethoxypropanenitrile
Molecular Mass 115.130 g·mol−1
Heat of Formation -263.3 ± 16.7 kJ·mol−1
Dipole Moment 3.64 ± 1.08 D
Volume 150.45 Å 3
Surface Area 153.64 Å 2
HOMO Energy -10.69 ± 0.55 eV
LUMO Energy 4.25 ± eV
Point Group Symmetry C1
Synonyms
  • 3,3-dimethoxypropionitrile
  • 3,3-dimethoxypropiononitrile
  • propanenitrile, 3,3-dimethoxy-
CAS Number(s)
  • 57597-62-3
InChIKey JYHSJQNYYLGMEI-UHFFFAOYSA-N
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