4-Chloro-3-Nitroaniline

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Properties Simple | Detailed

Formula C6H5ClN2O2
IUPAC Name 4-chloro-3-nitro-aniline
Molecular Mass 172.569 g·mol−1
Heat of Formation 47.7 ± 16.7 kJ·mol−1
Dipole Moment 7.21 ± 1.08 D
Volume 174.91 Å 3
Surface Area 175.95 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -1.37 ± eV
Point Group Symmetry Cs
Synonyms
  • (4-chloro-3-nitro-phenyl)amine
  • 3-nitro-4-chloroaniline
  • 4-amino-1-chloro-2-nitrobenzene
  • aniline, 4-chloro-3-nitro-
  • benzenamine, 4-chloro-3-nitro-
CAS Number(s)
  • 635-22-3
InChIKey FOHHWGVAOVDVLP-UHFFFAOYSA-N
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Elements H C N O Cl