4-Oxo-4,5,6,7-Tetrahydrobenzofuran-3-Carboxylic Acid

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Properties Simple | Detailed

Formula C9H8O4
IUPAC Name 4-oxo-6,7-dihydro-5h-benzofuran-3-carboxylic acid
Molecular Mass 180.157 g·mol−1
Heat of Formation -568.5 ± 16.7 kJ·mol−1
Dipole Moment 5.26 ± 1.08 D
Volume 197.37 Å 3
Surface Area 192.46 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
Synonyms
  • 4-keto-6,7-dihydro-5h-benzofuran-3-carboxylic acid
  • 4-oxo-6,7-dihydro-5h-1-benzofuran-3-carboxylic acid
  • 4-oxo-6,7-dihydro-5h-benzofuran-3-carboxylic acid
  • oprea1_302148
  • sdccgmls-0066243.p001
  • sr-01000638746-1
InChIKey FABBWECRHZNMDQ-UHFFFAOYSA-N
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