7-[(1R,2S)-2-{4-[(1S)-1-Hydroxyhexyl]Phenyl}-5-Oxocyclopentyl]Heptanoic Acid

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Formula C24H36O4
IUPAC Name 7-[(1r,2s)-2-[4-[(1s)-1-hydroxyhexyl]phenyl]-5-oxo-cyclopentyl]heptanoic acid
Molecular Mass 388.540 g·mol−1
Heat of Formation -934.6 ± 16.7 kJ·mol−1
Dipole Moment 3.99 ± 1.08 D
Volume 521.13 Å 3
Surface Area 457.91 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy 0.06 ± eV
Point Group Symmetry C1
Synonyms
  • 7-[(1r,2s)-2-[4-[(1s)-1-hydroxyhexyl]phenyl]-5-keto-cyclopentyl]enanthic acid
  • 7-[(1r,2s)-2-[4-[(1s)-1-hydroxyhexyl]phenyl]-5-oxo-cyclopentyl]heptanoic acid
  • 7-[(1r,2s)-2-[4-[(1s)-1-hydroxyhexyl]phenyl]-5-oxocyclopentyl]heptanoic acid
InChIKey XMQKDOCUWFCMEJ-VSKRKVRLSA-N
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Elements H C O