Ethyl 6-Bromo-2-Oxo-2H-Chromene-3-Carboxylate

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Properties Simple | Detailed

Formula C12H9BrO4
IUPAC Name ethyl 6-bromo-2-oxo-chromene-3-carboxylate
Molecular Mass 297.101 g·mol−1
Heat of Formation -504.5 ± 16.7 kJ·mol−1
Dipole Moment 1.30 ± 1.08 D
Volume 272.21 Å 3
Surface Area 262.31 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy -1.81 ± eV
Point Group Symmetry C1
Synonyms
  • 6-bromo-2-keto-chromene-3-carboxylic acid ethyl ester
  • 6-bromo-2-oxo-2h-chromene-3-carboxylic acid ethyl ester
  • 6-bromo-2-oxo-3-chromenecarboxylic acid ethyl ester
  • bas 00852496
  • ethyl 6-bromo-2-oxochromene-3-carboxylate
  • iflab1_000491
  • oprea1_573298
  • oprea1_663499
InChIKey RXGDNKCWEKUYQA-UHFFFAOYSA-N
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Elements H C O Br