Chem
J-GLOBAL ID：200907066013919659   Nikkaji number：J421.563J

2-Bromo-5,5-dimethyl-1,3-cyclohexanedione

2-ブロモ-5,5-ジメチル-1,3-シクロヘキサンジオン
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： C8H11BrO2
Molecular formula furigana： C8-H11-BR-O2
Molecular weight： 219.078
InChI： InChI=1S/C8H11BrO2/c1-8(2)3-5(10)7(9)6(11)4-8/h7H,3-4H2,1-2H3
InChI key： OCXANUSFMRALNG-UHFFFAOYSA-N
SMILES： CC1(C)CC(=O)C(Br)C(=O)C1
Systematic name  (3)：
  • 2-ブロモ-5,5-ジメチル-1,3-シクロヘキサンジオン
  • 2-ブロモ-5,5-ジメチルシクロヘキサン-1,3-ジオン
  • 2-bromo-5,5-dimethylcyclohexane-1,3-dione
Other name (2)：
  • 2-Bromo-5,5-dimethyl-1,3-cyclohexanedione
  • 2-Bromo-5,5-dimethylcyclohexane-1,3-dione
CAS registry number： 1195-91-1
Regulation number (1)：
  • TSCA(1195-91-1)
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