2,2'-Sulfinyldiacetic Acid

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Properties Simple | Detailed

Formula C4H6O5S
IUPAC Name 2-(carboxymethylsulfinyl)acetic acid
Molecular Mass 166.152 g·mol−1
Heat of Formation -886.2 ± 16.7 kJ·mol−1
Dipole Moment 3.79 ± 1.08 D
Volume 173.12 Å 3
Surface Area 177.91 Å 2
HOMO Energy -9.55 ± 0.55 eV
LUMO Energy 2.80 ± eV
Point Group Symmetry Cs
Synonyms
  • 2-(carboxymethylsulfinyl)ethanoic acid
  • bas 03182957
  • carboxymethanesulfinyl-acetic acid
  • thiodiacetic acid sulfoxide
CAS Number(s)
  • 33388-14-6
InChIKey AUKDKWLCVXCCBN-UHFFFAOYSA-N
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DOI
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Elements H S C O