(2S)-2-Hydroxy-3-[(1-Hydroxy-2-Methyl-2-Propanyl)Ammonio]-1-Propanesulfonate

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Properties Simple | Detailed

Formula C7H17NO5S
IUPAC Name (2s)-2-hydroxy-3-[(2-hydroxy-1,1-dimethyl-ethyl)amino]propane-1-sulfonic acid
Molecular Mass 227.279 g·mol−1
Heat of Formation -1000.5 ± 16.7 kJ·mol−1
Dipole Moment 4.68 ± 1.08 D
Volume 267.01 Å 3
Surface Area 244.1 Å 2
HOMO Energy -9.55 ± 0.55 eV
LUMO Energy 0.35 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-hydroxy-3-[(1-hydroxy-2-methyl-propan-2-yl)amino]propane-1-sulfonic acid
  • (2s)-2-hydroxy-3-[(1-hydroxy-2-methylpropan-2-yl)amino]propane-1-sulfonic acid
  • (2s)-2-hydroxy-3-[(2-hydroxy-1,1-dimethyl-ethyl)amino]propane-1-sulfonic acid
  • (2s)-2-hydroxy-3-[(2-hydroxy-1,1-dimethylethyl)amino]propane-1-sulfonic acid
InChIKey ACERFIHBIWMFOR-LURJTMIESA-N
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