2-Methylthioethyl Chloride

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Properties Simple | Detailed

Formula C3H7ClS
IUPAC Name 1-chloro-2-methylsulfanyl-ethane
Molecular Mass 110.606 g·mol−1
Heat of Formation -85.1 ± 16.7 kJ·mol−1
Dipole Moment 2.09 ± 1.08 D
Volume 131.44 Å 3
Surface Area 140.52 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.47 ± eV
Point Group Symmetry C1
Synonyms
  • .beta.-chloroethyl methyl sulfide
  • 1-chloro-2-(methylthio)ethane
  • 1-chloro-2-methylsulfanylethane
  • 2-(methylthio)ethyl chloride
  • 2-chloroethyl methyl sulfide
  • 2-chloroethyl methyl sulphide
  • ethane, 1-chloro-2-(methylthio)-
  • ethane, 1-chloro-2-(methylthio)- (9ci)
  • hemisulfur mustard
  • sulfide, 2-chloroethyl methyl
  • sulfide, 2-chloroethyl methyl (8ci)
CAS Number(s)
  • 542-81-4
InChIKey MYFKLQFBFSHBPA-UHFFFAOYSA-N
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Elements H S C Cl