4-(Bromomethyl)-7-Methoxy-2H-Chromen-2-One

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Properties Simple | Detailed

Formula C11H9BrO3
IUPAC Name 4-(bromomethyl)-7-methoxy-chromen-2-one
Molecular Mass 269.091 g·mol−1
Heat of Formation -346.9 ± 16.7 kJ·mol−1
Dipole Moment 4.00 ± 1.08 D
Volume 249.45 Å 3
Surface Area 236.21 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy 1.75 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1-benzopyran-2-one, 4-(bromomethyl)-7-methoxy-
  • 4-(bromomethyl)-7-methoxy-2-chromenone
  • 4-(bromomethyl)-7-methoxy-coumarin
  • 4-(bromomethyl)-7-methoxychromen-2-one
  • 4-bromomethyl-7-methoxy-2-oxo-2h-benzopyran
  • 4-bromomethyl-7-methoxycoumarin
  • br-mmc
CAS Number(s)
  • 35231-44-8
InChIKey CTENSLORRMFPDH-UHFFFAOYSA-N
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Elements H C O Br