1,1,1,3,3-Pentachloroacetone

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Properties Simple | Detailed

Formula C3HCl5O
IUPAC Name 1,1,1,3,3-pentachloropropan-2-one
Molecular Mass 230.304 g·mol−1
Heat of Formation -280.9 ± 16.7 kJ·mol−1
Dipole Moment 1.68 ± 1.08 D
Volume 194.51 Å 3
Surface Area 182.12 Å 2
HOMO Energy -11.18 ± 0.55 eV
LUMO Energy 1.27 ± eV
Point Group Symmetry C1
Synonyms
  • 1,1,1,3,3-pentachloropropanone
  • 2-propanone, 1,1,1,3,3-pentachloro-
  • pentachloroacetone
  • pentachloropropanone
CAS Number(s)
  • 1768-31-6
InChIKey RVSIFWBAGVMQKT-UHFFFAOYSA-N
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Elements H C O Cl