(3R,3As,4S,9As,9Br)-4-Hydroxy-3,6,9-Trimethyl-3,3A,4,5,9A,9B-Hexahydroazuleno[4,5-B]Furan-2,7-Dione

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Properties Simple | Detailed

Formula C15H18O4
IUPAC Name (3r,3as,4s,9as,9br)-4-hydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione
Molecular Mass 262.301 g·mol−1
Heat of Formation -665.6 ± 16.7 kJ·mol−1
Dipole Moment 4.51 ± 1.08 D
Volume 308.35 Å 3
Surface Area 261.48 Å 2
HOMO Energy -9.99 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,3as,4s,9as,9br)-4-hydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[5,4-d]furan-2,7-dione
  • (3r,3as,4s,9as,9br)-4-hydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[5,4-d]furan-2,7-quinone
InChIKey YMUOZXZDDBRJEP-GXTNAYEGSA-N
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