(4R)-3-[(2S)-2-Methyl-3-Sulfanylpropanoyl]-1,3-Thiazolidine-4-Carboxylic Acid

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Properties Simple | Detailed

Formula C8H13NO3S2
IUPAC Name (4r)-3-[(2s)-2-methyl-3-sulfanyl-propanoyl]thiazolidine-4-carboxylic acid
Molecular Mass 235.324 g·mol−1
Heat of Formation -555.2 ± 16.7 kJ·mol−1
Dipole Moment 2.76 ± 1.08 D
Volume 270.58 Å 3
Surface Area 239.96 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -0.63 ± eV
Point Group Symmetry C1
Synonyms
  • (4r)-3-((2s)-3-mercapto-2-methylpropanoyl)-4-thiazolidinecarboxylic acid
  • (4r)-3-[(2s)-2-methyl-3-sulfanyl-propanoyl]-1,3-thiazolidine-4-carboxylic acid
  • (4r)-3-[(2s)-2-methyl-3-sulfanyl-propanoyl]thiazolidine-4-carboxylic acid
  • (4r)-3-[(2s)-3-mercapto-2-methyl-1-oxopropyl]-4-thiazolidinecarboxylic acid
  • (4r)-3-[(2s)-3-mercapto-2-methyl-propanoyl]thiazolidine-4-carboxylic acid
  • 4-thiazolidinecarboxylic acid, 3-(3-mercapto-2-methyl-1-oxopropyl)-, (r-(r*,s*))-
  • sa 291
  • sa-291
  • ys 980
  • ys-980
CAS Number(s)
  • 67714-46-9
InChIKey FWNWATHTRVGPDX-RITPCOANSA-N
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