(3R)-3-(6-Hydroxy-1,3-Benzodioxol-5-Yl)-7-Methoxy-6-Chromanol

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Properties Simple | Detailed

Formula C17H16O6
IUPAC Name (3r)-3-(6-hydroxy-1,3-benzodioxol-5-yl)-7-methoxy-chroman-6-ol
Molecular Mass 316.305 g·mol−1
Heat of Formation -766.1 ± 16.7 kJ·mol−1
Dipole Moment 4.26 ± 1.08 D
Volume 347.72 Å 3
Surface Area 313.66 Å 2
HOMO Energy -8.19 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-3-(6-hydroxy-1,3-benzodioxol-5-yl)-7-methoxy-chroman-6-ol
InChIKey MBIKSISXYLIKEM-JTQLQIEISA-N
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Elements H C O