2-(Chloroamino)Ethanesulfonic Acid

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Properties Simple | Detailed

Formula C2H6ClNO3S
IUPAC Name 2-(chloroamino)ethanesulfonic acid
Molecular Mass 159.592 g·mol−1
Heat of Formation -475.7 ± 16.7 kJ·mol−1
Dipole Moment 3.73 ± 1.08 D
Volume 155.41 Å 3
Surface Area 162.56 Å 2
HOMO Energy -10.43 ± 0.55 eV
LUMO Energy -0.44 ± eV
Point Group Symmetry C1
Synonyms
  • ethanesulfonic acid, 2-(chloroamino)-
  • n-chlorotaurine
  • n-monochlorotaurine
  • taurine chloramine
  • taurine monochloramine
  • taurochloramine
CAS Number(s)
  • 51036-13-6
InChIKey NMMHHSLZJLPMEG-UHFFFAOYSA-N
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