1-(2-methyl-1-cyclohexenyl)-3-phenyl-propenone

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 肉桂酸及其衍生物
• 英文名称: 1-(2-methyl-1-cyclohexenyl)-3-phenyl-propenone
• 英文别名: Ibsywtvbbugsrd-vawyxsnfsa-；(E)-1-(2-methylcyclohexen-1-yl)-3-phenylprop-2-en-1-one
• 化学式: C₁₆H₁₈O
• 分子量: 226.318
• InChiKey: IBSYWTVBBUGSRD-VAWYXSNFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  trimethyl[1-(2-methyl-1-cyclohexen-1-yl)ethenyloxy]silane 在 对甲苯磺酸 、 zinc(II) iodide 作用下， 以 二氯甲烷 、 苯 为溶剂， 反应 9.0h， 生成 1-(2-methyl-1-cyclohexenyl)-3-phenyl-propenone
  参考文献：
  名称：

  A novel hetero-Diels-Alder approach towards perhydro quinolinones bearing an angular methyl group

  摘要：

  The title compounds 9-11 were synthesized by a hetero Diels-Alder reaction using the sterically demanding diene 2 as a new building block. The effect of commonly used Lewis acids and the substitution pattern of various imines 5 on both the mechanism and the diastereoselectivity of the reaction with the diene is discussed and compared with data obtained by ab initio calculations. (C) 1997 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(97)10339-8

文献信息

• REE, TEUNIS VAN, S. AFR. J. CHEM., 42,(1989) N, C. 139-145
  作者：REE, TEUNIS VAN

  DOI：——

  日期：——
• A novel hetero-Diels-Alder approach towards perhydro quinolinones bearing an angular methyl group
  作者：Peter Stanetty、Marko D Mihovilovic、Kurt Mereiter、Horst Völlenkle、Franz Renz

  DOI：10.1016/s0040-4020(97)10339-8

  日期：1998.1

  The title compounds 9-11 were synthesized by a hetero Diels-Alder reaction using the sterically demanding diene 2 as a new building block. The effect of commonly used Lewis acids and the substitution pattern of various imines 5 on both the mechanism and the diastereoselectivity of the reaction with the diene is discussed and compared with data obtained by ab initio calculations. (C) 1997 Elsevier Science Ltd. All rights reserved.

表征谱图