6-[(2R)-2,3-Dihydroxy-3-Methylbutyl]-5,7-Dimethoxy-2H-Chromen-2-One

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Properties Simple | Detailed

Formula C16H21O6+
IUPAC Name 6-[(2r)-2,3-dihydroxy-3-methyl-butyl]-5,7-dimethoxy-chromen-2-one
Molecular Mass 309.334 g·mol−1
Heat of Formation -957.3 ± 16.7 kJ·mol−1
Dipole Moment 7.69 ± 1.08 D
Volume 365.59 Å 3
Surface Area 312.37 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy -1.09 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1-benzopyran-2-one, 6-(2,3-dihydroxy-3-methylbutyl)-5,7-dimethoxy-
  • 6-[(2r)-2,3-dihydroxy-3-methyl-butyl]-5,7-dimethoxy-chromen-2-one
  • 6-[(2r)-2,3-dihydroxy-3-methyl-butyl]-5,7-dimethoxy-coumarin
  • 6-[(2r)-2,3-dihydroxy-3-methylbutyl]-5,7-dimethoxy-2-chromenone
  • 6-[(2r)-2,3-dihydroxy-3-methylbutyl]-5,7-dimethoxychromen-2-one
CAS Number(s)
  • 483-90-9
InChIKey GLWPLQBQHWYKRK-CYBMUJFWSA-N
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