5-[2-(Trifluoromethyl)Phenyl]-2-Furoic Acid

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Properties Simple | Detailed

Formula C12H7F3O3
IUPAC Name 5-[2-(trifluoromethyl)phenyl]furan-2-carboxylic acid
Molecular Mass 256.177 g·mol−1
Heat of Formation -950.0 ± 16.7 kJ·mol−1
Dipole Moment 4.96 ± 1.08 D
Volume 259.17 Å 3
Surface Area 237.21 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy 1.70 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(2-trifluoromethyl-phenyl)-furan-2-carboxylic acid
  • 5-[2-(trifluoromethyl)phenyl]-2-furancarboxylic acid
  • bas 02567039
  • kuc100872n
InChIKey IJPNRBZMRINMMR-UHFFFAOYSA-N
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