5-[(2R,3S)-4-(1,3-Benzodioxol-5-Yl)-2,3-Dimethylbutyl]-1,3-Benzodioxole

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Properties Simple | Detailed

Formula C20H22O4
IUPAC Name 5-[(2r,3s)-4-(1,3-benzodioxol-5-yl)-2,3-dimethyl-butyl]-1,3-benzodioxole
Molecular Mass 326.386 g·mol−1
Heat of Formation -457.4 ± 16.7 kJ·mol−1
Dipole Moment 0.53 ± 1.08 D
Volume 397.09 Å 3
Surface Area 347.31 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy 0.00 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[(2r,3s)-4-(1,3-benzodioxol-5-yl)-2,3-dimethyl-butyl]-1,3-benzodioxole
InChIKey QEFJURUMSHPMTC-OKILXGFUSA-N
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Elements H C O