(2S)-2-Ethoxy-3,3-Dimethyl-2,3-Dihydro-1-Benzofuran-5-Yl Methanesulfonate

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Properties Simple | Detailed

Formula C13H18O5S
IUPAC Name [(2s)-2-ethoxy-3,3-dimethyl-2h-benzofuran-5-yl] methanesulfonate
Molecular Mass 286.344 g·mol−1
Heat of Formation -843.1 ± 16.7 kJ·mol−1
Dipole Moment 2.93 ± 1.08 D
Volume 327.43 Å 3
Surface Area 297.69 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy 3.11 ± eV
Point Group Symmetry C1
Synonyms
  • [(2s)-2-ethoxy-3,3-dimethyl-2h-benzofuran-5-yl] methanesulfonate
  • methanesulfonic acid [(2s)-2-ethoxy-3,3-dimethyl-2h-benzofuran-5-yl] ester
InChIKey IRCMYGHHKLLGHV-LBPRGKRZSA-N
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