4-(Oxoacetyl)Benzoic Acid

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Properties Simple | Detailed

Formula C9H6O4
IUPAC Name 4-oxaldehydoylbenzoic acid
Molecular Mass 178.142 g·mol−1
Heat of Formation -500.9 ± 16.7 kJ·mol−1
Dipole Moment 1.84 ± 1.08 D
Volume 196.06 Å 3
Surface Area 195.26 Å 2
HOMO Energy -10.26 ± 0.55 eV
LUMO Energy 1.46 ± eV
Point Group Symmetry C1
Synonyms
  • 4-(2-oxo-acetyl)-benzoic acid
  • 4-carboxyphenylglyoxal
  • 4-glyoxyloylbenzoic acid
  • benzoic acid, 4-(oxoacetyl)-
  • p-carboxyphenylglyoxal
  • p-carboxyphenylglyoxal treated bovine serum albumin
  • p-carboxyphenylglyoxal treated bsa
  • pcpg
CAS Number(s)
  • 20099-54-1
InChIKey NTJTXGBCDNPQIV-UHFFFAOYSA-N
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Elements H C O