2,3,5-Tris(Methylsulfanyl)-1,4-Benzenediol

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Properties Simple | Detailed

Formula C9H12O2S3
IUPAC Name 2,3,5-tris(methylsulfanyl)benzene-1,4-diol
Molecular Mass 248.385 g·mol−1
Heat of Formation -277.7 ± 16.7 kJ·mol−1
Dipole Moment 1.92 ± 1.08 D
Volume 272.76 Å 3
Surface Area 247.39 Å 2
HOMO Energy -7.81 ± 0.55 eV
LUMO Energy 2.23 ± eV
Point Group Symmetry C1
Synonyms
  • 2,3,5-tris(methylthio)benzene-1,4-diol
  • 2,3,5-tris(methylthio)hydroquinone
  • t 1801 a
  • t1801 a
CAS Number(s)
  • 127087-16-5
InChIKey PUTXYHAWWBIFFE-UHFFFAOYSA-N
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