Chem
J-GLOBAL ID：200907040833708599   Nikkaji number：J479.867H

1-Methyldibenzothiophene

1-メチル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： C13H10S
Molecular formula furigana： C13-H10-S
Molecular weight： 198.280
InChI： InChI=1S/C13H10S/c1-9-5-4-8-12-13(9)10-6-2-3-7-11(10)14-12/h2-8H,1H3
InChI key： HORCQSAKJDDBKB-UHFFFAOYSA-N
SMILES： Cc1cccc2sc3ccccc3c12
Systematic name  (4)：
  • 1-メチルジベンゾチオフェン
  • 9-メチルジベンゾチオフェン
  • 3-メチル-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
  • 3-methyl-8-thiatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
Other name (2)：
  • 9-Methyldibenzothiophene
  • 1-Methyldibenzothiophene
CAS registry number： 31317-07-4
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