(6R,7As)-6-Allyl-7A-(4-Allyl-2-Tert-Butoxyphenoxy)-7,7A-Dihydro-1,3-Benzodioxol-5(6H)-One

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Properties Simple | Detailed

Formula C23H28O5
IUPAC Name (6r,7as)-6-allyl-7a-(4-allyl-2-tert-butoxy-phenoxy)-6,7-dihydro-1,3-benzodioxol-5-one
Molecular Mass 384.465 g·mol−1
Heat of Formation -652.5 ± 16.7 kJ·mol−1
Dipole Moment 4.53 ± 1.08 D
Volume 478.51 Å 3
Surface Area 373.33 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy -0.39 ± eV
Point Group Symmetry C1
Synonyms
  • (6r,7as)-6-allyl-7a-(4-allyl-2-tert-butoxy-phenoxy)-6,7-dihydro-1,3-benzodioxol-5-one
  • (6r,7as)-6-allyl-7a-(4-allyl-2-tert-butoxyphenoxy)-6,7-dihydro-1,3-benzodioxol-5-one
  • (6r,7as)-7a-[2-[(2-methylpropan-2-yl)oxy]-4-prop-2-enyl-phenoxy]-6-prop-2-enyl-6,7-dihydro-1,3-benzodioxol-5-one
  • (6r,7as)-7a-[2-[(2-methylpropan-2-yl)oxy]-4-prop-2-enylphenoxy]-6-prop-2-enyl-6,7-dihydro-1,3-benzodioxol-5-one
  • didymochlaenone a
InChIKey CNYSZXKNPDBKCH-UZUQRXQVSA-N
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