S-(2,2-Dichlorovinyl)-L-Cysteine

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Properties Simple | Detailed

Formula C5H7Cl2NO2S
IUPAC Name (2r)-2-amino-3-(2,2-dichlorovinylsulfanyl)propanoic acid
Molecular Mass 216.086 g·mol−1
Heat of Formation -358.7 ± 16.7 kJ·mol−1
Dipole Moment 3.04 ± 1.08 D
Volume 216.22 Å 3
Surface Area 198.48 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy -0.81 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-amino-3-(2,2-dichloroethenylsulfanyl)propanoic acid
  • (2r)-2-amino-3-(2,2-dichlorovinylsulfanyl)propanoic acid
  • (2r)-2-amino-3-(2,2-dichlorovinylthio)propanoic acid
  • (2r)-2-amino-3-(2,2-dichlorovinylthio)propionic acid
  • alanine, 3-((2,2-dichlorovinyl)thio)-, l-
CAS Number(s)
  • 3326-09-8
InChIKey HTUPGSGHOGPTAF-VKHMYHEASA-N
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