4-Bromo-3-(Carboxymethoxy)-5-Phenyl-2-Thiophenecarboxylic Acid

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Properties Simple | Detailed

Formula C13H9BrO5S
IUPAC Name 4-bromo-3-(carboxymethoxy)-5-phenyl-thiophene-2-carboxylic acid
Molecular Mass 357.177 g·mol−1
Heat of Formation -642.7 ± 16.7 kJ·mol−1
Dipole Moment 3.80 ± 1.08 D
Volume 329.54 Å 3
Surface Area 297.64 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -1.53 ± eV
Point Group Symmetry C1
Synonyms
  • 4-bromo-3-(carboxymethoxy)-5-phenylthiophene-2-carboxylic acid
  • 4-bromo-3-(carboxymethyloxy)-5-phenyl-2-thenoic acid
  • 4-bromo-3-(carboxymethyloxy)-5-phenyl-2-thiophenecarboxylic acid
  • 4-bromo-3-(carboxymethyloxy)-5-phenyl-thiophene-2-carboxylic acid
  • 4-bromo-3-(carboxymethyloxy)-5-phenylthiophene-2-carboxylic acid
InChIKey MVDWLRCTJUXCCB-UHFFFAOYSA-N
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Elements H C Br S O