Chem
J-GLOBAL ID：200907099869043288
Nikkaji number：J1.794.116J
3-(α-Hydroxybenzyl)-4H-1-benzothiopyran-4-one
3-[ヒドロキシ(フェニル)メチル]-4H-チオクロメン-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： C16H12O2S
Molecular formula furigana： C16-H12-O2-S
Molecular weight： 268.330
InChI：
InChI=1S/C16H12O2S/c17-15(11-6-2-1-3-7-11)13-10-19-14-9-5-4-8-12(14)16(13)18/h1-10,15,17H
InChI key：
BBGAZYMZLWDZIL-UHFFFAOYSA-N
SMILES：
OC(c1ccccc1)c1csc2ccccc2c1=O
Systematic name (3)：
- 3-(α-ヒドロキシベンジル)-4H-1-ベンゾチオピラン-4-オン
- 3-[ヒドロキシ(フェニル)メチル]-4H-チオクロメン-4-オン
- 3-[hydroxy(phenyl)methyl]-4H-thiochromen-4-one
- 3-(α-Hydroxybenzyl)-4H-1-benzothiopyran-4-one
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