3-[(S)-Methylsulfinyl]-L-Alanine

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Properties Simple | Detailed

Formula C4H9NO3S
IUPAC Name (2r)-2-azaniumyl-3-[(s)-methylsulfinyl]propanoate
Molecular Mass 151.184 g·mol−1
Heat of Formation -437.5 ± 16.7 kJ·mol−1
Dipole Moment 7.24 ± 1.08 D
Volume 167.0 Å 3
Surface Area 166.6 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy 3.45 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-amino-3-[(s)-methylsulfinyl]propanoic acid
  • (2r)-2-amino-3-[(s)-methylsulfinyl]propionic acid
CAS Number(s)
  • 32726-14-0
InChIKey ZZLHPCSGGOGHFW-KTCWOMIQSA-N
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