Scoparone

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Properties Simple | Detailed

Formula C11H10O4
IUPAC Name 6,7-dimethoxychromen-2-one
Molecular Mass 206.195 g·mol−1
Heat of Formation -468.8 ± 16.7 kJ·mol−1
Dipole Moment 6.89 ± 1.08 D
Volume 232.42 Å 3
Surface Area 222.96 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 1.94 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1-benzopyran-2-one, 6,7-dimethoxy-
  • 6,7-dimethoxy-2-benzopyrone
  • 6,7-dimethoxy-2-chromenone
  • 6,7-dimethoxy-2h-1-benzopyran-2-one
  • 6,7-dimethoxybenzopyran-2-one
  • 6,7-dimethoxycoumarin
  • 6,7-dimethylesculetin
  • acon1_002079
  • aesculetin dimethyl ether
  • benzopyran-2-one, 6,7-dimethoxy- (9ci)
  • coumarin, 6,7-dimethoxy-
  • escoparone
  • esculetin dimethyl ether
  • megxp0_001422
  • scoparon
  • scopoletin methyl ether
  • sr-01000631300-1
CAS Number(s)
  • 120-08-1
InChIKey GUAFOGOEJLSQBT-UHFFFAOYSA-N
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