(1S,3As,4R,6Ar)-1,4-Bis(4-Hydroxy-3-Methoxyphenyl)Dihydro-1H,3H-Furo[3,4-C]Furan-3A(4H)-Yl Acetate

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Properties Simple | Detailed

Formula C22H24O8
IUPAC Name [(3r,3as,6s,6ar)-3,6-bis(4-hydroxy-3-methoxy-phenyl)-3,4,6,6a-tetrahydro-1h-furo[3,4-c]furan-3a-yl] acetate
Molecular Mass 416.421 g·mol−1
Heat of Formation -1193.5 ± 16.7 kJ·mol−1
Dipole Moment 4.64 ± 1.08 D
Volume 468.3 Å 3
Surface Area 384.64 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy 2.95 ± eV
Point Group Symmetry C1
Synonyms
  • 1-acetoxypinoresinol
  • [(1r,3ar,4s,6as)-1,4-bis(4-hydroxy-3-methoxy-phenyl)-3,3a,4,6-tetrahydro-1h-furo[3,4-c]furan-6a-yl] acetate
  • [(1r,3ar,4s,6as)-1,4-bis(4-hydroxy-3-methoxy-phenyl)-3,3a,4,6-tetrahydro-1h-furo[3,4-c]furan-6a-yl] ethanoate
  • [(1r,3ar,4s,6as)-1,4-bis(4-hydroxy-3-methoxyphenyl)-3,3a,4,6-tetrahydro-1h-furo[3,4-c]furan-6a-yl] acetate
  • acetic acid [(1r,3ar,4s,6as)-1,4-bis(4-hydroxy-3-methoxy-phenyl)-3,3a,4,6-tetrahydro-1h-furo[3,4-c]furan-6a-yl] ester
  • acetic acid [(1r,3ar,4s,6as)-1,4-bis(4-hydroxy-3-methoxyphenyl)-3,3a,4,6-tetrahydro-1h-furo[3,4-c]furan-6a-yl] ester
CAS Number(s)
  • 81426-14-4
InChIKey NATDFORNCKZPCI-FPHUIIFBSA-N
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