(3Ar,4R,5S,6S,7R,7As)-Hexahydrospiro[1,3-Benzodioxole-2,1'-Cyclohexane]-4,5,6,7-Tetrol

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Formula C12H20O6
IUPAC Name (3ar,4r,5s,6s,7r,7as)-spiro[3a,4,5,6,7,7a-hexahydro-1,3-benzodioxole-2,1'-cyclohexane]-4,5,6,7-tetrol
Molecular Mass 260.284 g·mol−1
Heat of Formation -1205.9 ± 16.7 kJ·mol−1
Dipole Moment 1.77 ± 1.08 D
Volume 298.44 Å 3
Surface Area 252.63 Å 2
HOMO Energy -10.10 ± 0.55 eV
LUMO Energy 1.34 ± eV
Point Group Symmetry C1
Synonyms
  • (3ar,4r,5s,6s,7r,7as)-spiro[3a,4,5,6,7,7a-hexahydro-1,3-benzodioxole-2,1'-cyclohexane]-4,5,6,7-tetrol
  • 2,3-o-chmi
  • 2,3-o-cyclohexylidene-myo-inositol
InChIKey SOONKKMMJCQOLI-JYRVZRIJSA-N
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