2-(Bromoamino)Ethanesulfonic Acid

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Properties Simple | Detailed

Formula C2H6BrNO3S
IUPAC Name n-bromo-2-sulfo-ethanamine
Molecular Mass 204.043 g·mol−1
Heat of Formation -426.6 ± 16.7 kJ·mol−1
Dipole Moment 3.37 ± 1.08 D
Volume 162.8 Å 3
Surface Area 169.39 Å 2
HOMO Energy -10.31 ± 0.55 eV
LUMO Energy -1.74 ± eV
Point Group Symmetry C1
Synonyms
  • ethanesulfonic acid, 2-(bromoamino)-
  • n-bromotaurine
  • taurine bromamine
CAS Number(s)
  • 52316-57-1
InChIKey USAWSWBIFACPGD-UHFFFAOYSA-N
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Elements C H O N S Br