(Methylthio)Acetic Acid

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Properties Simple | Detailed

Formula C3H6O2S
IUPAC Name 2-methylsulfanylacetic acid
Molecular Mass 106.144 g·mol−1
Heat of Formation -403.1 ± 16.7 kJ·mol−1
Dipole Moment 2.78 ± 1.08 D
Volume 123.77 Å 3
Surface Area 132.89 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy 2.71 ± eV
Point Group Symmetry C1
Synonyms
  • (methylmercapto)acetic acid
  • (methylsulfanyl)acetic acid
  • 2-(methylthio)acetic acid
  • 2-methylsulfanylethanoic acid
  • 2-methylthioacetic acid
  • acetic acid, (methylthio)-
  • s-methylthioglycolate
  • t5215415
CAS Number(s)
  • 2444-37-3
InChIKey HGTBAIVLETUVCG-UHFFFAOYSA-N
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