(Dimethylsulfonio)Acetate

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Properties Simple | Detailed

Formula C4H8O2S
IUPAC Name carbon dioxide; methanidyl(dimethyl)sulfonium
Molecular Mass 120.170 g·mol−1
Heat of Formation -306.5 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 152.91 Å 3
Surface Area 155.77 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy 4.14 ± eV
Point Group Symmetry C1
Synonyms
  • 2-dimethylsulfonioethanoate
  • dimethylsulfonioacetate
  • sulfobetaine
  • sulfonium, (carboxymethyl)dimethyl-, hydroxide, inner salt
CAS Number(s)
  • 4727-41-7
InChIKey PSBDWGZCVUAZQS-UHFFFAOYSA-N
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