Chem
J-GLOBAL ID：200907091133338867   Nikkaji number：J1.490.078K

1-(2-Ethynylbenzyl)-2-methylenecyclohexanecarboxylic acid ethyl ester

1-(2-エチニルベンジル)-2-メチレンシクロヘキサンカルボン酸エチル
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： C19H22O2
Molecular formula furigana： C19-H22-O2
Molecular weight： 282.383
InChI： InChI=1S/C19H22O2/c1-4-16-11-6-7-12-17(16)14-19(18(20)21-5-2)13-9-8-10-15(19)3/h1,6-7,11-12H,3,5,8-10,13-14H2,2H3
InChI key： MQIHGKHESPFLGY-UHFFFAOYSA-N
SMILES： CCOC(=O)C1(Cc2ccccc2C#C)CCCCC1=C
Systematic name  (3)：
  • 1-(2-エチニルベンジル)-2-メチレンシクロヘキサンカルボン酸エチル
  • エチル 1-[(2-エチニルフェニル)メチル]-2-メチリデンシクロヘキサン-1-カルボキシラート
  • ethyl 1-[(2-ethynylphenyl)methyl]-2-methylidenecyclohexane-1-carboxylate
Other name (1)：
  • 1-(2-Ethynylbenzyl)-2-methylenecyclohexanecarboxylic acid ethyl ester
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