4-(Oxoacetyl)Benzenesulfonic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C8H6O5S
IUPAC Name 4-oxaldehydoylbenzenesulfonic acid
Molecular Mass 214.195 g·mol−1
Heat of Formation -658.4 ± 16.7 kJ·mol−1
Dipole Moment 1.89 ± 1.08 D
Volume 217.28 Å 3
Surface Area 211.06 Å 2
HOMO Energy -10.38 ± 0.55 eV
LUMO Energy 1.39 ± eV
Point Group Symmetry C1
Synonyms
  • 4-glyoxyloylbenzenesulfonic acid
  • 4-sulfonylphenylglyoxal
  • benzenesulfonic acid, 4-(oxoacetyl)-
  • para-sulfonylphenylglyoxal
CAS Number(s)
  • 67014-03-3
InChIKey OKQBJZOLLMZHSH-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O