2-Methylthioaniline

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Properties Simple | Detailed

Formula C7H9NS
IUPAC Name 2-methylsulfanylaniline
Molecular Mass 139.218 g·mol−1
Heat of Formation 78.4 ± 16.7 kJ·mol−1
Dipole Moment 2.00 ± 1.08 D
Volume 172.89 Å 3
Surface Area 171.89 Å 2
HOMO Energy -8.49 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(methylmercapto)aniline
  • 2-(methylthio)aniline
  • 2-aminothioanisole
  • 2-methylmercaptoaniline
  • [2-(methylthio)phenyl]amine
CAS Number(s)
  • 2987-53-3
InChIKey WBRPQQSADOCKCH-UHFFFAOYSA-N
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Elements H S C N