5-[(3S)-1,2-Dithiolan-3-Yl]Pentanoic Acid

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Properties Simple | Detailed

Formula C8H14O2S2
IUPAC Name 5-[(3s)-dithiolan-3-yl]pentanoic acid
Molecular Mass 206.326 g·mol−1
Heat of Formation -459.3 ± 16.7 kJ·mol−1
Dipole Moment 4.42 ± 1.08 D
Volume 248.17 Å 3
Surface Area 237.4 Å 2
HOMO Energy -8.23 ± 0.55 eV
LUMO Energy -1.00 ± eV
Point Group Symmetry C1
Synonyms
  • (s)-(-)-lipoic acid
  • (s)-1,2-dithiolane-3-pentanoic acid
  • (s)-lipoic acid
  • 1,2-dithiolane-3-pentanoic acid, (s)-
  • 5-(1,2-dithiolan-3-yl)pentanoato
  • 5-[(3s)-3-dithiolanyl]pentanoic acid
  • 5-[(3s)-dithiolan-3-yl]pentanoic acid
  • 5-[(3s)-dithiolan-3-yl]valeric acid
  • s-lipoate
CAS Number(s)
  • 1077-27-6
InChIKey AGBQKNBQESQNJD-ZETCQYMHSA-N
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