1,3-Benzodioxol-5-Yl[(3S,4R,5S)-5-(1,3-Benzodioxol-5-Yl)-4-(Hydroxymethyl)Tetrahydro-3-Furanyl]Methanone

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Properties Simple | Detailed

Formula C20H18O7
IUPAC Name 1,3-benzodioxol-5-yl-[(3s,4r,5s)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)tetrahydrofuran-3-yl]methanone
Molecular Mass 370.353 g·mol−1
Heat of Formation -852.1 ± 16.7 kJ·mol−1
Dipole Moment 4.18 ± 1.08 D
Volume 411.93 Å 3
Surface Area 325.16 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy 2.40 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-benzodioxol-5-yl-[(3s,4r,5s)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)-3-tetrahydrofuranyl]methanone
  • 1,3-benzodioxol-5-yl-[(3s,4r,5s)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)oxolan-3-yl]methanone
  • 1,3-benzodioxol-5-yl-[(3s,4r,5s)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)tetrahydrofuran-3-yl]methanone
  • 1,3-benzodioxol-5-yl-[(3s,4r,5s)-5-(1,3-benzodioxol-5-yl)-4-methylol-tetrahydrofuran-3-yl]methanone
  • methanone, 1,3-benzodioxol-5-yl(5-(1,3-benzodioxol-5-yl)tetrahydro-4-(hydroxymethyl)-3-furanyl)-, (3s-(3alpha,4beta,5alpha))-
  • sesaminone
CAS Number(s)
  • 157207-93-7
InChIKey RZIWMSJDPYUACC-LRDNONRASA-N
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