(3-Bromo-4-Hydroxyphenyl)(2-Ethyl-1-Benzofuran-3-Yl)Methanone

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Properties Simple | Detailed

Formula C17H13BrO3
IUPAC Name (3-bromo-4-hydroxy-phenyl)-(2-ethylbenzofuran-3-yl)methanone
Molecular Mass 345.187 g·mol−1
Heat of Formation -237.9 ± 16.7 kJ·mol−1
Dipole Moment 2.33 ± 1.08 D
Volume 341.22 Å 3
Surface Area 305.38 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy -0.63 ± eV
Point Group Symmetry C1
Synonyms
  • (3-bromo-4-hydroxy-phenyl)-(2-ethyl-1-benzofuran-3-yl)methanone
  • (3-bromo-4-hydroxyphenyl)-(2-ethyl-3-benzofuranyl)methanone
  • bromobenzarone
  • methanone, (3-bromo-4-hydroxyphenyl)(2-ethyl-3-benzofuranyl)-
CAS Number(s)
  • 94729-09-6
InChIKey QXZXBNDIHSUZDF-UHFFFAOYSA-N
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Elements H C O Br