6,6-dichloro-4-(5-ethoxyhept-1-yl)bicyclo[3.2.0]heptan-7-one

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 6,6-dichloro-4-(5-ethoxyhept-1-yl)bicyclo[3.2.0]heptan-7-one
• 英文别名: 7,7-dichloro-2-(5-ethoxyhept-1-yl)bicyclo[3.2.0]heptan-6-one {7,7-dichloro-2-(5-ethoxyheptyl)bicyclo [3.2.0]heptan-6-one}；6,6-Dichloro-4-(5-ethoxyhept-1-yl)bicyclo[3.2.0]-heptan-7-one；7,7-dichloro-2-(5-ethoxyheptyl)bicyclo[3.2.0]heptan-6-one
• 化学式: C₁₆H₂₆Cl₂O₂
• 分子量: 321.287
• InChiKey: JJTPNKNATNOUNE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  20
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.94
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  二氯乙酰氯 生成 6,6-dichloro-4-(5-ethoxyhept-1-yl)bicyclo[3.2.0]heptan-7-one
  参考文献：
  名称：

  KASHA, WALTER J.;BURNISON, CHANTAL S.

  摘要：

  DOI：

文献信息

• [EN] METHOD OF SYNTHESIS<br/>[FR] PROCÉDÉ DE SYNTHÈSE
  申请人：BCS BUSINESS CONSULTING SERVICES PTE LTD

  公开号：WO2014140655A1

  公开（公告）日：2014-09-18

  Described is a method of synthesizing 6-(5-ethoxyhept-1-yl)bicyclo[3.3.0] octan-3-one by reacting 3-(5-ethoxyhept-1-yl) cyclopentene with dichloroketene. The resulting reaction products are reacted with acetic acid and zinc to produce 4-(5-ethoxyhept-1 -yl)bicyclo[3.2.0]heptan-6-one and 4-(5-ethoxyhept-1-yl)bicyclo [3.2.0]heptan-7-one, which are reacted with trimethylsulfonium iodide to produce 2-(5-ethoxyhept-1-yl)spiro[bicyclo[3.2.0]heptane-6,2'-oxirane] and 4-(5-ethoxyhept-1-yl)spiro-[bicyclo-[3.2.0]heptane-6,2'-oxirane]. Lithium iodide is reacted with 2-(5-ethoxyhept-1-yl)spiro[bicyclo[3.2.0]heptane-6,2'-oxirane] and 4-(5-ethoxyhept-1-yl)spiro-[bicyclo-[3.2.0]heptane-6,2'-oxirane] to produce 6-(5-ethoxyhept-1-yl)bicyclo[3.3.0]octan-3-one. A method of synthesizing 6-(5-methoxyhept-1-yl)bicyclo[3.3.0]octan-3-one is also described.

  描述了一种合成6-(5-乙氧基庚-1-基)双环[3.3.0]辛烷-3-酮的方法，通过将3-(5-乙氧基庚-1-基)环戊烯与二氯酮反应。所得的反应产物与乙酸和锌反应，生成4-(5-乙氧基庚-1-基)双环[3.2.0]庚烷-6-酮和4-(5-乙氧基庚-1-基)双环[3.2.0]庚烷-7-酮，再与碘化三甲基硫銨反应，产生2-(5-乙氧基庚-1-基)螺[双环[3.2.0]庚烷-6,2'-环氧烷]和4-(5-乙氧基庚-1-基)螺-[双环-[3.2.0]庚烷-6,2'-环氧烷]。碘化锂与2-(5-乙氧基庚-1-基)螺[双环[3.2.0]庚烷-6,2'-环氧烷]和4-(5-乙氧基庚-1-基)螺-[双环-[3.2.0]庚烷-6,2'-环氧烷]反应，生成6-(5-乙氧基庚-1-基)双环[3.3.0]辛烷-3-酮。还描述了一种合成6-(5-甲氧基庚-1-基)双环[3.3.0]辛烷-3-酮的方法。
• Method of synthesis
  申请人：Van Wiltenburg Jimmy

  公开号：US08410314B1

  公开（公告）日：2013-04-02

  Described is a method of synthesizing 6-(5-ethoxyhept-1-yl)bicyclo[3.3.0]octan-3-one by reacting 3-(5-ethoxyhept-1-yl)cyclopentene with dichloroketene. The resulting reaction products are reacted with acetic acid and zinc to produce 4-(5-ethoxyhept-1-yl)bicyclo[3.2.0]heptan-6-one and 4-(5-ethoxyhept-1-yl)bicyclo[3.2.0]heptan-7-one, which are reacted with trimethylsulfonium iodide to produce 2-(5-ethoxyhept-1-yl)spiro[bicyclo[3.2.0]heptane-6,2′-oxirane] and 4-(5-ethoxyhept-1-yl)spiro-[bicyclo-[3.2.0] heptane-6,2′-oxirane]. Lithium iodide is reacted with 2-(5-ethoxyhept-1-yl)spiro[bicyclo[3.2.0]heptane-6,2′-oxirane] and 4-(5-ethoxyhept-1-yl)spiro-[bicyclo-[3.2.0]heptane-6,2′-oxirane] to produce 6-(5-ethoxyhept-1-yl)bicyclo[3.3.0]octan-3-one. A method of synthesizing 6-(5-methoxyhept-1-yl)bicyclo[3.3.0]octan-3-one is also described.

  本发明涉及一种合成6-(5-乙氧庚-1-基)双环[3.3.0]辛-3-酮的方法，该方法通过将3-(5-乙氧庚-1-基)环戊烯与二氯酮反应得到反应产物，然后将反应产物与乙酸和锌反应，得到4-(5-乙氧庚-1-基)双环[3.2.0]庚-6-酮和4-(5-乙氧庚-1-基)双环[3.2.0]庚-7-酮，再将其与碘化三甲基硫脲反应，得到2-(5-乙氧庚-1-基)螺[双环[3.2.0]庚烷-6,2'-环氧]和4-(5-乙氧庚-1-基)螺[双环[3.2.0]庚烷-6,2'-环氧]。然后将锂碘与2-(5-乙氧庚-1-基)螺[双环[3.2.0]庚烷-6,2'-环氧]和4-(5-乙氧庚-1-基)螺[双环[3.2.0]庚烷-6,2'-环氧]反应，得到6-(5-乙氧庚-1-基)双环[3.3.0]辛-3-酮。本发明还涉及一种合成6-(5-甲氧庚-1-基)双环[3.3.0]辛-3-酮的方法。
• METHOD OF SYNTHESIS
  申请人：BCS BUSINESS CONSULTING SERVICES PTE LTD.

  公开号：US20160016874A1

  公开（公告）日：2016-01-21

  Described is a method of synthesizing 6-(5-ethoxyhept-1-yl)bicyclo[3.3.0] octan-3-one by reacting 3-(5-ethoxyhept-1-yl) cyclopentene with dichloroketene. The resulting reaction products are reacted with acetic acid and zinc to produce 4-(5-ethoxy-hept-1-yl)bicyclo[3.2.0]heptan-6-one and 4-(5-ethoxyhept-1-yl)bicyclo[3.2.0]heptan-7-one, which are reacted with trimethylsulfonium iodide to produce 2-(5-ethoxyhept-1-yl)spiro[bicyclo[3.2.0]heptane-6,2′-oxirane] and 4-(5-ethoxyhept-1-yl)spiro-[bicyclo[3.2.0]heptane-6,2′-oxirane]. Lithium iodide is reacted with 2-(5-ethoxyhept-1-yl)spiro[bicyclo[3.2.0]heptane-6,2′-oxirane] and 4-(5-ethoxyhept-1-yl)spiro-[bicyclo-[3.2.0]heptane-6,2′-oxirane] to produce 6-(5-ethoxyhept-1-yl)bicyclo[3.3.0]octan-3-one. A method of synthesizing 6-(5-methoxyhept-1-yl)bicyclo[3.3.0]octan-3-one is also described.

  本文描述了一种通过将3-(5-乙氧已基)环戊烯与二氯酮烯反应合成6-(5-乙氧已基)bicyclo[3.3.0]辛-3-酮的方法。然后将反应产物与乙酸和锌反应，得到4-(5-乙氧已基)bicyclo[3.2.0]庚-6-酮和4-(5-乙氧已基)bicyclo[3.2.0]庚-7-酮，再与三甲基硫铵碘反应，得到2-(5-乙氧已基)螺[双环[3.2.0]庚烷-6,2'-环氧]和4-(5-乙氧已基)螺[双环[3.2.0]庚烷-6,2'-环氧]。最后，将锂碘与2-(5-乙氧已基)螺[双环[3.2.0]庚烷-6,2'-环氧]和4-(5-乙氧已基)螺[双环[3.2.0]庚烷-6,2'-环氧]反应，得到6-(5-乙氧已基)bicyclo[3.3.0]辛-3-酮。文章还描述了一种合成6-(5-甲氧已基)bicyclo[3.3.0]辛-3-酮的方法。
• Method of synthesis of methoxyheptyl bicyclooctanone
  申请人：Grey Pacific Labs, LLC

  公开号：US10150724B2

  公开（公告）日：2018-12-11

  Described is a method of synthesizing 6-(5-ethoxyhept-1-yl)bicyclo[3.3.0] octan-3-one by reacting 3-(5-ethoxyhept-1-yl) cyclopentene with dichloroketene. The resulting reaction products are reacted with acetic acid and zinc to produce 4-(5-ethoxyhept-1-yl)bicyclo[3.2.0]heptan-6-one and 4-(5-ethoxyhept-1-yl)bicyclo [3.2.0]heptan-7-one, which are reacted with trimethylsulfonium iodide to produce 2-(5-ethoxyhept-1-yl)spiro[bicyclo[3.2.0]heptane-6,2′-oxirane] and 4-(5-ethoxyhept-1-yl)spiro-[bicyclo-[3.2.0]heptane-6,2′-oxirane]. Lithium iodide is reacted with 2-(5-ethoxyhept-1-yl)spiro[bicyclo[3.2.0]heptane-6,2′-oxirane] and 4-(5-ethoxyhept-1-yl)spiro-[bicyclo-[ 3.2.0]heptane-6,2′-oxirane] to produce 6-(5-ethoxyhept-1-yl)bicyclo[3.3.0]octan-3-one. A method of synthesizing 6-(5-methoxyhept-1-yl)bicyclo[3.3.0]octan-3-one is also described.

  描述了一种通过 3-(5-乙氧基庚-1-基)环戊烯与二氯甲烷反应合成 6-(5-乙氧基庚-1-基)双环[3.3.0]辛烷-3-酮的方法。反应生成物与乙酸和锌反应生成 4-(5-乙氧基庚-1-基)双环[3.2.0]庚-6-酮和 4-(5-乙氧基庚-1-基)双环[3.2.0]庚烷-7-酮，与三甲基碘化锍反应生成 2-(5-乙氧基庚-1-基)螺[双环[3.2.0]庚烷-6,2′-环氧乙烷]和 4-(5-乙氧基庚-1-基)螺[双环[3.2.0]庚烷-6,2′-环氧乙烷]。碘化锂与 2-(5-乙氧基庚-1-基)螺[双环[3.2.0]庚烷-6,2′-环氧乙烷]和 4-(5-乙氧基庚-1-基)螺[双环[3.2.0]庚烷-6,2′-环氧乙烷]反应，生成 6-(5-乙氧基庚-1-基)双环[3.3.0]辛烷-3-酮。还描述了合成 6-(5-甲氧基庚-1-基)双环[3.3.0]辛-3-酮的方法。
• KASHA, WALTER J.;BURNISON, CHANTAL S.
  作者：KASHA, WALTER J.、BURNISON, CHANTAL S.

  DOI：——

  日期：——