3-Nitrochlorobenzene

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Properties Simple | Detailed

Formula C6H4ClNO2
IUPAC Name 1-chloro-3-nitro-benzene
Molecular Mass 157.554 g·mol−1
Heat of Formation 44.7 ± 16.7 kJ·mol−1
Dipole Moment 4.25 ± 1.08 D
Volume 161.05 Å 3
Surface Area 165.8 Å 2
HOMO Energy -10.51 ± 0.55 eV
LUMO Energy -1.64 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-chloro-3-nitrobenzene
  • 1-chloronitrobenzene
  • 1-nitro-3-chlorobenzene
  • 3-chloro-1-nitrobenzene
  • 3-chloronitrobenzene
  • benzene, 1-chloro-3-nitro-
  • chloro-m-nitrobenzene
  • chloronitrobenzenes meta or para, solid [un1578] [poison]
  • ghl.pd_mitscher_leg0.940
  • m-chloronitrobenzene
  • m-nitrochlorobenzene
  • metachloronitrobenzene
  • nitrochlorobenzene, meta-, solid
CAS Number(s)
  • 121-73-3
InChIKey KMAQZIILEGKYQZ-UHFFFAOYSA-N
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