Chem
J-GLOBAL ID：200907081245146787   Nikkaji number：J393.996K

(4,6-2H2)Dibenzothiophene

(4,6-2H2)ジベンゾチオフェン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C12H6[2H]2S
Molecular formula furigana： C12-H8-S
Molecular weight： 186.270
InChI： InChI=1S/C12H8S/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H/i7D,8D
InChI key： IYYZUPMFVPLQIF-QTQOOCSTSA-N
SMILES： c1([2H])cccc2c1sc1c([2H])cccc21
Systematic name  (3)：
  • (4,6-2H2)ジベンゾチオフェン
  • (6,10-2H2)-8-チアトリシクロ[7.4.0.02,7]トリデカ-1(9),2(7),3,5,10,12-ヘキサエン
  • (6,10-2H2)-8-thiatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
Other name (1)：
  • (4,6-2H2)Dibenzothiophene
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