Chem
J-GLOBAL ID：200907066259038490   Nikkaji number：J6.185I

Thujic acid

ツヤ酸
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/c1-10(2)6-3-4-8(5-7-10)9(11)12/h3-7H,1-2H3,(H,11,12)
InChI key： JHHXPQAUADQJBQ-UHFFFAOYSA-N
SMILES： CC1(C)C=CC=C(C=C1)C(=O)O
Systematic name  (3)：
  • 5,5-ジメチル-1,3,6-シクロヘプタトリエン-1-カルボン酸
  • 5,5-ジメチルシクロヘプタ-1,3,6-トリエン-1-カルボン酸
  • 5,5-dimethylcyclohepta-1,3,6-triene-1-carboxylic acid
Other name (5)：
  • ツヤ酸
  • デヒドロペリル酸
  • Thujic acid
  • Dehydroperillic acid
  • 5,5-Dimethyl-1,3,6-cycloheptatriene-1-carboxylic acid
CAS registry number： 499-89-8
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