5-(5-Methyl-1,3-Dioxan-4-Yl)-1,3-Benzodioxole

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Properties Simple | Detailed

Formula C12H14O4
IUPAC Name 5-[(4r,5r)-5-methyl-1,3-dioxan-4-yl]-1,3-benzodioxole
Molecular Mass 222.237 g·mol−1
Heat of Formation -539.5 ± 16.7 kJ·mol−1
Dipole Moment 2.13 ± 1.08 D
Volume 256.73 Å 3
Surface Area 236.09 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy 0.02 ± eV
Point Group Symmetry C1
InChIKey VSBPRBXTUAKKSY-PRHODGIISA-N
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