3-Oxooctanoic Acid

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Properties Simple | Detailed

Formula C8H14O3
IUPAC Name 3-oxooctanoic acid
Molecular Mass 158.195 g·mol−1
Heat of Formation -673.2 ± 16.7 kJ·mol−1
Dipole Moment 2.73 ± 1.08 D
Volume 208.09 Å 3
Surface Area 210.16 Å 2
HOMO Energy -10.50 ± 0.55 eV
LUMO Energy 3.33 ± eV
Point Group Symmetry C1
Synonyms
  • 3-keto-n-caprylic acid
  • 3-ketocaprylic acid
  • 3-ketooctanoic acid
  • 3-oxo-octanoic acid
  • lmfa01060017
  • octanoic acid, 3-oxo-
  • ooa
CAS Number(s)
  • 13283-91-5
InChIKey FWNRRWJFOZIGQZ-UHFFFAOYSA-N
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Elements H C O