Chem
J-GLOBAL ID：202007019413545480   Nikkaji number：J3.754.038B

2-[4-(1-ヘキシニル)-2-ヒドロキシフェニル]ベンゾチアゾール

2-[4-(1-ヘキシニル)-2-ヒドロキシフェニル]ベンゾチアゾール
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： C19H17NOS
Molecular formula furigana： C19-H17-N-O-S
Molecular weight： 307.410
InChI： InChI=1S/C19H17NOS/c1-2-3-4-5-8-14-11-12-15(17(21)13-14)19-20-16-9-6-7-10-18(16)22-19/h6-7,9-13,21H,2-4H2,1H3
InChI key： WAPDNLXSEVGRMM-UHFFFAOYSA-N
SMILES： c12sc(nc1cccc2)c1c(cc(cc1)C#CCCCC)O
Systematic name  (3)：
  • 2-[4-(1-ヘキシニル)-2-ヒドロキシフェニル]ベンゾチアゾール
  • 2-(1,3-ベンゾチアゾール-2-イル)-5-(ヘキサ-1-イン-1-イル)フェノール
  • 2-(1,3-benzothiazol-2-yl)-5-(hex-1-yn-1-yl)phenol
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