(3S,4S)-4-(1,3-Benzodioxol-5-Ylmethyl)-3-(3,4,5-Trimethoxybenzyl)Dihydro-2(3H)-Furanone

Molecule SVG Image

Properties Simple | Detailed

Formula C22H24O7
IUPAC Name (3s,4s)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]tetrahydrofuran-2-one
Molecular Mass 400.422 g·mol−1
Heat of Formation -956.1 ± 16.7 kJ·mol−1
Dipole Moment 5.96 ± 1.08 D
Volume 460.62 Å 3
Surface Area 344.58 Å 2
HOMO Energy -8.87 ± 0.55 eV
LUMO Energy -0.11 ± eV
Point Group Symmetry C1
Synonyms
  • (3s,4s)-4-(1,3-benzodioxol-5-ylmethyl)-3-(3,4,5-trimethoxybenzyl)tetrahydrofuran-2-one
  • (3s,4s)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]-2-tetrahydrofuranone
  • (3s,4s)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one
  • (3s,4s)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]tetrahydrofuran-2-one
InChIKey GMLDZDDTZKXJLU-CVEARBPZSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O