Chem
J-GLOBAL ID：200907014682821044   Nikkaji number：J1.236.284F

1,2,3,4,6,8,9-Heptamethyldibenzothiophene 5,5-dioxide

1,2,3,4,6,8,9-ヘプタメチルジベンゾチオフェン5,5-ジオキシド
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： C19H22[O-]2[S+2]
Molecular formula furigana： C19-H22-O2-S
Molecular weight： 314.440
InChI： InChI=1S/C19H22O2S/c1-9-8-10(2)18-16(11(9)3)17-14(6)12(4)13(5)15(7)19(17)22(18,20)21/h8H,1-7H3
InChI key： JWKJDVYECPQPJZ-UHFFFAOYSA-N
SMILES： Cc1cc(C)c(C)c2c3c(c(C)c(C)c(C)c3C)[S+2]([O-])([O-])c12
Systematic name  (3)：
  • 1,2,3,4,6,8,9-ヘプタメチルジベンゾチオフェン5,5-ジオキシド
  • 3,4,5,6,10,12,13-ヘプタメチル-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-8,8-ジイウム-8,8-ビス(オラート)
  • 3,4,5,6,10,12,13-heptamethyl-8-thiatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,8-diium-8,8-bis(olate)
Other name (1)：
  • 1,2,3,4,6,8,9-Heptamethyldibenzothiophene 5,5-dioxide
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