Chem
J-GLOBAL ID：200907003557630588   Nikkaji number：J1.808.344B

4-[4-(Hydroxymethyl)benzyl]-3-methylenecyclohexane-1,1-dicarboxylic acid diethyl ester

4-[4-(ヒドロキシメチル)ベンジル]-3-メチレンシクロヘキサン-1,1-ジカルボン酸ジエチル
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： C21H28O5
Molecular formula furigana： C21-H28-O5
Molecular weight： 360.450
InChI： InChI=1S/C21H28O5/c1-4-25-19(23)21(20(24)26-5-2)11-10-18(15(3)13-21)12-16-6-8-17(14-22)9-7-16/h6-9,18,22H,3-5,10-14H2,1-2H3
InChI key： SNKDSARUKHXKIM-UHFFFAOYSA-N
SMILES： CCOC(=O)C1(CCC(Cc2ccc(CO)cc2)C(=C)C1)C(=O)OCC
Systematic name  (3)：
  • 4-[4-(ヒドロキシメチル)ベンジル]-3-メチレンシクロヘキサン-1,1-ジカルボン酸ジエチル
  • 1,1-ジエチル 4-{[4-(ヒドロキシメチル)フェニル]メチル}-3-メチリデンシクロヘキサン-1,1-ジカルボキシラート
  • 1,1-diethyl 4-{[4-(hydroxymethyl)phenyl]methyl}-3-methylidenecyclohexane-1,1-dicarboxylate
Other name (1)：
  • 4-[4-(Hydroxymethyl)benzyl]-3-methylenecyclohexane-1,1-dicarboxylic acid diethyl ester
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