(3As,6S,6Ar,9As,9Br)-6A-Hydroxy-6,9A-Dimethyl-3-Methylenedecahydroazuleno[4,5-B]Furan-2,9-Dione

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Properties Simple | Detailed

Formula C15H20O4
IUPAC Name (3as,6s,6ar,9as,9br)-6a-hydroxy-6,9a-dimethyl-3-methylene-4,5,6,7,8,9b-hexahydro-3ah-azuleno[8,7-b]furan-2,9-dione
Molecular Mass 264.317 g·mol−1
Heat of Formation -693.9 ± 16.7 kJ·mol−1
Dipole Moment 6.61 ± 1.08 D
Volume 316.94 Å 3
Surface Area 259.33 Å 2
HOMO Energy -9.96 ± 0.55 eV
LUMO Energy 2.87 ± eV
Point Group Symmetry C1
Synonyms
  • (3as,6s,6ar,9as,9br)-6a-hydroxy-6,9a-dimethyl-3-methylene-4,5,6,7,8,9b-hexahydro-3ah-azuleno[7,8-d]furan-2,9-dione
  • (3as,6s,6ar,9as,9br)-6a-hydroxy-6,9a-dimethyl-3-methylene-4,5,6,7,8,9b-hexahydro-3ah-azuleno[7,8-d]furan-2,9-quinone
  • (3as,6s,6ar,9as,9br)-6a-hydroxy-6,9a-dimethyl-3-methylidene-4,5,6,7,8,9b-hexahydro-3ah-azuleno[7,8-d]furan-2,9-dione
  • azuleno[4,5-b]furan-2,9-dione, decahydro-6a-hydroxy-6,9a-dimethyl-3-methylene-, (3as,6s,6ar,9as,9br)-
  • azuleno[4,5-b]furan-2,9-dione, decahydro-6a-hydroxy-6,9a-dimethyl-3-methylene-, [3as-(3a.alpha.,6.beta.,6a.alpha.,9a.beta.,9b.alpha.)]-
  • coronopilin
  • coronopolin
CAS Number(s)
  • 2571-81-5
InChIKey GEUJJEYGSRWXPC-JISBIHODSA-N
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