2-Acetamidoethanesulfonic Acid

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Properties Simple | Detailed

Formula C4H9NO4S
IUPAC Name 2-acetamidoethanesulfonic acid
Molecular Mass 167.184 g·mol−1
Heat of Formation -795.5 ± 16.7 kJ·mol−1
Dipole Moment 1.30 ± 1.08 D
Volume 177.99 Å 3
Surface Area 179.34 Å 2
HOMO Energy -9.97 ± 0.55 eV
LUMO Energy 3.31 ± eV
Point Group Symmetry C1
Synonyms
  • acetyltaurine
  • magnesium acetyltaurinate
  • taurine, n-acetyl-
CAS Number(s)
  • 19213-70-8
InChIKey CXJAAWRLVGAKDV-UHFFFAOYSA-N
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