Chem
J-GLOBAL ID：201207042053505210
Nikkaji number：J3.039.062H
3-(1,3-Dithiane-2-yl)-4H-1-benzopyran-4-one
3-(1,3-ジチアン-2-イル)-4H-クロメン-4-オン
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
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
Molecular formula： C13H12O2S2
Molecular formula furigana： C13-H12-O2-S2
Molecular weight： 264.360
InChI：
InChI=1S/C13H12O2S2/c14-12-9-4-1-2-5-11(9)15-8-10(12)13-16-6-3-7-17-13/h1-2,4-5,8,13H,3,6-7H2
InChI key：
LYYMYGNCESQRAA-UHFFFAOYSA-N
SMILES：
O=c1c(coc2ccccc12)C1SCCCS1
Systematic name (3)：
- 3-(1,3-ジチアン-2-イル)-4H-1-ベンゾピラン-4-オン
- 3-(1,3-ジチアン-2-イル)-4H-クロメン-4-オン
- 3-(1,3-dithian-2-yl)-4H-chromen-4-one
- 3-(1,3-Dithiane-2-yl)-4H-1-benzopyran-4-one
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