P-Tolyl Methyl Sulfone

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Properties Simple | Detailed

Formula C8H10O2S
IUPAC Name 1-methyl-4-methylsulfonyl-benzene
Molecular Mass 170.229 g·mol−1
Heat of Formation -291.2 ± 16.7 kJ·mol−1
Dipole Moment 6.19 ± 1.08 D
Volume 197.69 Å 3
Surface Area 193.67 Å 2
HOMO Energy -10.06 ± 0.55 eV
LUMO Energy 2.59 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-mesyl-4-methyl-benzene
  • 1-methyl-4-(methylsulfonyl)benzene
  • 1-methyl-4-methylsulfonylbenzene
  • 4-(methylsulfonyl)toluene
  • benzene, 1-methyl-4-(methylsulfonyl)-
  • benzene, 1-methyl-4-(methylsulfonyl)- (9ci)
  • crystar
  • methyl 4-tolylsulfone
  • methyl p-tolyl sulfone
  • p-(methylsulphonyl)toluene
  • p-methylsulfonyltoluene
  • sr-01000639213-1
  • sulfone, methyl p-tolyl
  • sulfone, methyl p-tolyl (8ci)
CAS Number(s)
  • 3185-99-7
InChIKey YYDNBUBMBZRNQQ-UHFFFAOYSA-N
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