Chloroacetonitrile

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Properties Simple | Detailed

Formula C2H2ClN
IUPAC Name 2-chloroacetonitrile
Molecular Mass 75.497 g·mol−1
Heat of Formation 73.1 ± 16.7 kJ·mol−1
Dipole Moment 3.26 ± 1.08 D
Volume 85.56 Å 3
Surface Area 102.2 Å 2
HOMO Energy -11.55 ± 0.55 eV
LUMO Energy -0.49 ± eV
Point Group Symmetry Cs
Synonyms
  • .alpha.-chloroacetonitrile
  • 2-chloroethanenitrile
  • acetic acid,chloro,nitrile
  • acetonitrile, chloro-
  • alpha-chloroacetonitrile
  • chloracetonitrile
  • chloroacetonitrile [un2668] [poison]
  • chloroethanenitrile
  • chloromethyl cyanide
  • monochloroacetonitrile
  • monochloromethyl cyanide
  • usaf kf-5
CAS Number(s)
  • 107-14-2
  • 1867-10-3
InChIKey RENMDAKOXSCIGH-UHFFFAOYSA-N
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Elements H C Cl N