9-Oxoprostan-1-Oic Acid

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Properties Simple | Detailed

Formula C20H36O3
IUPAC Name 7-[(1r,2s)-2-octyl-5-oxo-cyclopentyl]heptanoic acid
Molecular Mass 324.498 g·mol−1
Heat of Formation -901.8 ± 16.7 kJ·mol−1
Dipole Moment 3.67 ± 1.08 D
Volume 459.17 Å 3
Surface Area 427.39 Å 2
HOMO Energy -9.91 ± 0.55 eV
LUMO Energy 0.92 ± eV
Point Group Symmetry C1
Synonyms
  • 7-[(1r,2s)-2-octyl-5-oxo-cyclopentyl]heptanoic acid
  • 7-[(1r,2s)-2-octyl-5-oxocyclopentyl]heptanoic acid
  • 7-[(1r,5s)-2-keto-5-octyl-cyclopentyl]enanthic acid
  • 9-oxoprostanoic acid
  • prostan-1-oic acid, 9-oxo-, (+-)-
CAS Number(s)
  • 64122-56-1
InChIKey OHRKAMAYIWYKCQ-ZWKOTPCHSA-N
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Elements H C O