(2R)-3-Ammonio-2-(4-Chlorophenyl)-2-Hydroxy-1-Propanesulfonate

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Properties Simple | Detailed

Formula C9H12ClNO4S
IUPAC Name (2r)-3-amino-2-(4-chlorophenyl)-2-hydroxy-propane-1-sulfonic acid
Molecular Mass 265.714 g·mol−1
Heat of Formation -704.6 ± 16.7 kJ·mol−1
Dipole Moment 3.53 ± 1.08 D
Volume 276.46 Å 3
Surface Area 247.04 Å 2
HOMO Energy -9.85 ± 0.55 eV
LUMO Energy -0.51 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-3-amino-2-(4-chlorophenyl)-2-hydroxy-propane-1-sulfonic acid
  • (2r)-3-amino-2-(4-chlorophenyl)-2-hydroxypropane-1-sulfonic acid
CAS Number(s)
  • 117354-64-0
InChIKey WBSMZVIMANOCNX-SECBINFHSA-N
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Elements C Cl H O N S