(2S)-3-Amino-2-(4-Chlorophenyl)-2-Hydroxy-1-Propanesulfonic Acid

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Properties Simple | Detailed

Formula C9H12ClNO4S
IUPAC Name (2s)-3-amino-2-(4-chlorophenyl)-2-hydroxy-propane-1-sulfonic acid
Molecular Mass 265.714 g·mol−1
Heat of Formation -681.3 ± 16.7 kJ·mol−1
Dipole Moment 2.11 ± 1.08 D
Volume 280.71 Å 3
Surface Area 252.39 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-3-ammonio-2-(4-chlorophenyl)-2-hydroxy-propane-1-sulfonate
  • (2s)-3-ammonio-2-(4-chlorophenyl)-2-hydroxypropane-1-sulfonate
  • (2s)-3-azaniumyl-2-(4-chlorophenyl)-2-hydroxy-propane-1-sulfonate
  • (2s)-3-azaniumyl-2-(4-chlorophenyl)-2-hydroxypropane-1-sulfonate
InChIKey WBSMZVIMANOCNX-VIFPVBQESA-N
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Elements C Cl H O N S