4-Chlorophenyl Methyl Sulfide

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Properties Simple | Detailed

Formula C7H7ClS
IUPAC Name 1-chloro-4-methylsulfanyl-benzene
Molecular Mass 158.648 g·mol−1
Heat of Formation 49.1 ± 16.7 kJ·mol−1
Dipole Moment 2.36 ± 1.08 D
Volume 180.34 Å 3
Surface Area 180.31 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-chloro-4-(methylthio)benzene
  • 1-chloro-4-methylsulfanylbenzene
  • 4-chlorothioanisole
  • benzene, 1-chloro-4-(methylthio)-
  • methyl 4-chlorophenyl sulfide
  • methyl p-chlorophenyl sulfide
  • methyl-p-chlorophenyl sulfide
  • p-chlophenyl methyl sulfide
  • p-chlorophenyl methyl sulfide
  • p-chlorothioanisole
  • sulfide, p-chlorophenyl methyl
CAS Number(s)
  • 123-09-1
InChIKey KIQQUVJOLVCZKG-UHFFFAOYSA-N
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Elements H S C Cl