Ethyl 5-Chloro-2,2,3,3,4,4-Hexafluoro-5-Oxopentanoate

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Properties Simple | Detailed

Formula C7H5ClF6O3
IUPAC Name ethyl 5-chloro-2,2,3,3,4,4-hexafluoro-5-oxo-pentanoate
Molecular Mass 286.556 g·mol−1
Heat of Formation -1793.2 ± 16.7 kJ·mol−1
Dipole Moment 3.41 ± 1.08 D
Volume 252.03 Å 3
Surface Area 223.91 Å 2
HOMO Energy -11.74 ± 0.55 eV
LUMO Energy 1.83 ± eV
Point Group Symmetry C1
Synonyms
  • 4-carbethoxyhexafluorobutyryl chloride
  • 4ce-hfba
  • 5-chloro-2,2,3,3,4,4-hexafluoro-5-keto-valeric acid ethyl ester
  • 5-chloro-2,2,3,3,4,4-hexafluoro-5-oxopentanoic acid ethyl ester
  • pentanoic acid, 5-chloro-2,2,3,3,4,4-hexafluoro-5-oxo-, ethyl ester
CAS Number(s)
  • 18381-53-8
InChIKey OLRXGDHRDQKNGW-UHFFFAOYSA-N
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Elements H C F O Cl