6-Methyl-2-(Propylsulfonyl)Thieno[3,2-D][1,2,3]Diazaborinin-1(2H)-Ol

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Properties Simple | Detailed

Formula C9H13BN2O3S2
IUPAC Name 1-hydroxy-6-methyl-2-propylsulfonyl-thieno[3,2-d]diazaborinine
Molecular Mass 272.152 g·mol−1
Heat of Formation -630.0 ± 16.7 kJ·mol−1
Dipole Moment 6.79 ± 1.08 D
Volume 296.25 Å 3
Surface Area 275.21 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2-dihydro-1-hydroxy-6-methyl-2-(propanesulfonyl)-thieno(3,2d)(1,2,3)-diazaborine
  • 1-hydroxy-6-methyl-2-propylsulfonyl-thieno[3,2-d][1,2,3]diazaborinine
  • 1-hydroxy-6-methyl-2-propylsulfonylthieno[3,2-d]diazaborinine
  • 6-methyl-2(propane-1-sulfonyl)-2h-thieno[3,2-d][1,2,3]diazaborinin-1-ol
  • diazaborine compound 2b18
  • pkf 84.474
  • sa 84474
  • tdb
  • thieno(3,2-d)(1,2,3)diazaborine, 1,2-dihydro-1-hydroxy-6-methyl-2-(propylsulfonyl)-
CAS Number(s)
  • 67398-03-2
InChIKey TVXLILKNSPCVRB-UHFFFAOYSA-N
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