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

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Formula C21H22O6
IUPAC Name (3r,4r)-3-(1,3-benzodioxol-5-ylmethyl)-4-[(3,4-dimethoxyphenyl)methyl]tetrahydrofuran-2-one
Molecular Mass 370.396 g·mol−1
Heat of Formation -771.1 ± 16.7 kJ·mol−1
Dipole Moment 4.38 ± 1.08 D
Volume 450.61 Å 3
Surface Area 346.51 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -0.10 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4r)-3-(1,3-benzodioxol-5-ylmethyl)-4-(3,4-dimethoxybenzyl)tetrahydrofuran-2-one
  • (3r,4r)-3-(1,3-benzodioxol-5-ylmethyl)-4-[(3,4-dimethoxyphenyl)methyl]-2-tetrahydrofuranone
  • (3r,4r)-3-(1,3-benzodioxol-5-ylmethyl)-4-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one
  • (3r,4r)-3-(1,3-benzodioxol-5-ylmethyl)-4-[(3,4-dimethoxyphenyl)methyl]tetrahydrofuran-2-one
InChIKey LEVKKQBBEVGIKN-JKSUJKDBSA-N
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