(3R,4R)-4-(1,3-Benzodioxol-5-Ylmethyl)-3-(4-Hydroxy-3-Methoxybenzyl)Dihydro-2(3H)-Furanone

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Properties Simple | Detailed

Formula C20H20O6
IUPAC Name (3r,4r)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(4-hydroxy-3-methoxy-phenyl)methyl]tetrahydrofuran-2-one
Molecular Mass 356.369 g·mol−1
Heat of Formation -830.4 ± 16.7 kJ·mol−1
Dipole Moment 5.41 ± 1.08 D
Volume 411.95 Å 3
Surface Area 311.97 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 2.81 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4r)-4-(1,3-benzodioxol-5-ylmethyl)-3-(4-hydroxy-3-methoxy-benzyl)tetrahydrofuran-2-one
  • (3r,4r)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(4-hydroxy-3-methoxy-phenyl)methyl]oxolan-2-one
  • (3r,4r)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(4-hydroxy-3-methoxy-phenyl)methyl]tetrahydrofuran-2-one
  • (3r,4r)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2-tetrahydrofuranone
  • (3r,4r)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
  • 2(3h)-furanone, 4-(1,3-benzodioxol-5-ylmethyl)dihydro-3-((4-hydroxy-3-methoxyphenyl)methyl)-, (3r-trans)-
  • pluviatolide
CAS Number(s)
  • 28115-68-6
InChIKey OCTZTNYFALPGHW-LSDHHAIUSA-N
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