(3R)-6,8-Dimethoxy-3-Methyl-3,4-Dihydro-1H-Isochromen-1-One

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Properties Simple | Detailed

Formula C12H14O4
IUPAC Name (3r)-6,8-dimethoxy-3-methyl-isochroman-1-one
Molecular Mass 222.237 g·mol−1
Heat of Formation -599.7 ± 16.7 kJ·mol−1
Dipole Moment 5.62 ± 1.08 D
Volume 260.73 Å 3
Surface Area 245.08 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-6,8-dimethoxy-3-methyl-1-isochromanone
  • (3r)-6,8-dimethoxy-3-methyl-isochroman-1-one
  • (3r)-6,8-dimethoxy-3-methylisochroman-1-one
InChIKey XANBXQAFBJDNNB-SSDOTTSWSA-N
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Elements H C O