(1S,3R,9S,10R)-9-Hydroxy-3-Methyl-4,11-Dioxabicyclo[8.1.0]Undecane-5,7-Dione

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Properties Simple | Detailed

Formula C10H14O5
IUPAC Name (1s,3r,9s,10r)-9-hydroxy-3-methyl-4,11-dioxabicyclo[8.1.0]undecane-5,7-dione
Molecular Mass 214.215 g·mol−1
Heat of Formation -820.5 ± 16.7 kJ·mol−1
Dipole Moment 2.55 ± 1.08 D
Volume 247.41 Å 3
Surface Area 218.84 Å 2
HOMO Energy -10.57 ± 0.55 eV
LUMO Energy 3.27 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,3r,9s,10r)-9-hydroxy-3-methyl-4,11-dioxabicyclo[8.1.0]undecane-5,7-quinone
  • 4,11-dioxabicyclo(8.1.0)undecane-5,7-dione, 9-hydroxy-3-methyl-
  • decarestrictine b
CAS Number(s)
  • 127393-91-3
InChIKey XYYINJYPZZOQLA-RKBOWSCOSA-N
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