6-{[(1S,2R)-2-(1-Octyn-1-Yl)Cyclopentyl]Oxy}Hexanoic Acid

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Properties Simple | Detailed

Formula C19H32O3
IUPAC Name 6-[(1s,2r)-2-oct-1-ynylcyclopentoxy]hexanoic acid
Molecular Mass 308.456 g·mol−1
Heat of Formation -625.3 ± 16.7 kJ·mol−1
Dipole Moment 1.27 ± 1.08 D
Volume 437.34 Å 3
Surface Area 337.68 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy 1.02 ± eV
Point Group Symmetry C1
Synonyms
  • 6-[(1s,2r)-2-oct-1-ynylcyclopentoxy]hexanoic acid
  • hexanoic acid, 6-((2-(1-octynyl)cyclopentyl)oxy)-
CAS Number(s)
  • 22707-29-5
InChIKey LMIVPBDTHGWOLX-ROUUACIJSA-N
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