2-Thiaheptane

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Properties Simple | Detailed

Formula C6H14S
IUPAC Name 1-methylsulfanylpentane
Molecular Mass 118.240 g·mol−1
Heat of Formation -116.9 ± 16.7 kJ·mol−1
Dipole Moment 1.89 ± 1.08 D
Volume 174.38 Å 3
Surface Area 181.86 Å 2
HOMO Energy -8.40 ± 0.55 eV
LUMO Energy 3.28 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-(methylthio)pentane
  • methyl n-pentyl sulfide
  • methyl pentyl sulfide
  • methylthiapentane
  • pentane, 1-(methylthio)-
  • sulfide, methyl pentyl
CAS Number(s)
  • 1741-83-9
InChIKey FOJGPFUFFHWGFQ-UHFFFAOYSA-N
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Elements H C S