Chem
J-GLOBAL ID：200907069488433377   Nikkaji number：J12.272F

α-Thujaplicin

α-ツジャプリシン
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： C10H12O2
Molecular formula furigana： C10-H12-O2
Molecular weight： 164.204
InChI： InChI=1S/C10H12O2/c1-7(2)8-5-3-4-6-9(11)10(8)12/h3-7H,1-2H3,(H,11,12)
InChI key： TUFYVOCKVJOUIR-UHFFFAOYSA-N
SMILES： CC(C)c1ccccc(=O)c1O
Systematic name  (5)：
  • 2-ヒドロキシ-3-(1-メチルエチル)-2,4,6-シクロヘプタトリエン-1-オン
  • 2-ヒドロキシ-3-イソプロピルシクロヘプタ-2,4,6-トリエン-1-オン
  • 2-ヒドロキシ-3-イソプロピル-2,4,6-シクロヘプタトリエン-1-オン
  • 2-ヒドロキシ-3-(プロパン-2-イル)シクロヘプタ-2,4,6-トリエン-1-オン
  • 2-hydroxy-3-(propan-2-yl)cyclohepta-2,4,6-trien-1-one
Other name (5)：
  • α-ツジャプリシン
  • α-Thujaplicin
  • α-ツヤプリシン
  • 2-Hydroxy-3-isopropylcyclohepta-2,4,6-trien-1-one
  • 2-Hydroxy-3-isopropyl-2,4,6-cycloheptatriene-1-one
CAS registry number： 1946-74-3
Regulation number (1)：
  • (9)-1526
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