1,1-二氯-2,3-二苯基环丙烷 | 59130-21-1

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 中文名称: 1,1-二氯-2,3-二苯基环丙烷
• 英文名称: 1,1-dichloro trans-2,3-diphenylcyclopropane
• 英文别名: 1,1-dichloro-cis-2,3-diphenylcyclopropane；1,1-dichlorocis-2,3-diphenylcyclopropane；(2,2-dichloro-3-phenylcyclopropyl)benzene
• CAS: 59130-21-1
• 化学式: C₁₅H₁₂Cl₂
• 分子量: 263.166
• InChiKey: DJDNTZDWSNETAS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  17
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为反应物：
  描述：

  1,1-二氯-2,3-二苯基环丙烷 以 盐酸 、 水 、 水合甲醇 为溶剂， 生成 1,2-二苯基环丙烷
  参考文献：
  名称：

  Cyclopropyl analogs as estrogenic and anti-fertility agents

  摘要：

  雌激素环丙基类似物，在给予雌性受试者时，可作为抗生育剂，以预防受试者怀孕。此外，雌激素环丙基类似物可用作雌激素剂，以在雌性受试者中产生雌激素反应。作为雌激素剂有用的雌激素环丙基类似物具有以下一般结构：##STR1## 其中：X是卤素或氢原子；R.sub.1是氢原子，含有1至约3个碳原子的烷基基团，单环基团，羟基取代的单环基团，或烷氧基取代的单环基团，其中烷基取代基团含有1至约3个碳原子；R.sub.2是氢原子，醋酸基团，羟基，烷氧基，其中烷基取代基团含有1至约3个碳原子，β-二烷基氨基乙氧基基团，其中烷基取代基团含有1至约3个碳原子，β-单氨基杂环基乙氧基基团，或其药用可接受盐；R.sub.3是氢原子，或含有1至约3个碳原子的烷基基团；R.sub.4是氢原子，醋酸基团，羟基，或烷氧基，其中烷基取代基团含有1至约3个碳原子。

  公开号：

  US04442119A1
• 作为产物：
  描述：

  反式-1,2-二苯乙烯 、 氯仿 在 sodium hydroxide 、 苄基三乙基氯化铵 作用下， 反应 7.0h， 生成 1,1-二氯-2,3-二苯基环丙烷
  参考文献：
  名称：

  Kostikov, R. R.; Varakin, G. S.; Ogloblin, K. A., Journal of Organic Chemistry USSR (English Translation), 1983, vol. 19, # 8, p. 1438 - 1444

  摘要：

  DOI：

文献信息

• Cyclopropyl analogs as estrogenic and anti-fertility agents
  申请人：The Board of Regents for the University of Oklahoma

  公开号：US04442119A1

  公开（公告）日：1984-04-10

  Estrogenic cyclopropyl analogs, when administered to a female subject, function as anti-fertility agents to prevent pregnancy in the subject. Further, the estrogenic cyclopropyl analogs may be used as estrogenic agents to produce an estrogenic response in a female subject. The estrogenic cyclopropyl analogs useful as estrogenic agents have the general structure: ##STR1## wherein: X is a halogen or hydrogen atom: R.sub.1 is a hydrogen atom, an alkyl group containing from 1 to about 3 carbon atoms, a monocyclic group, a hydroxy substituted monocyclic group, or an alkoxy substituted monocyclic group in which the alkyl substitutent contains from 1 to about 3 carbon atoms; R.sub.2 is a hydrogen atom, an acetate group, a hydroxyl group, an alkoxy group in which the alkyl substituent contains from 1 to about 3 carbon atoms, a beta-dialkylaminoethoxy group in which the alkyl substituent contains from 1 to about 3 carbon atoms, a beta-monoaminoheterocycloethoxy group, or pharmaceutically acceptable salts thereof; R.sub.3 is a hydrogen atom, or an alkyl group containing from 1 to about 3 carbon atoms; R.sub.4 is a hydrogen atom, an acetate group, a hydroxyl group, or an alkoxy group in which the alkyl substituent contains from 1 to about 3 carbon atoms.

  雌激素环丙基类似物，在给予雌性受试者时，可作为抗生育剂，以预防受试者怀孕。此外，雌激素环丙基类似物可用作雌激素剂，以在雌性受试者中产生雌激素反应。作为雌激素剂有用的雌激素环丙基类似物具有以下一般结构：##STR1## 其中：X是卤素或氢原子；R.sub.1是氢原子，含有1至约3个碳原子的烷基基团，单环基团，羟基取代的单环基团，或烷氧基取代的单环基团，其中烷基取代基团含有1至约3个碳原子；R.sub.2是氢原子，醋酸基团，羟基，烷氧基，其中烷基取代基团含有1至约3个碳原子，β-二烷基氨基乙氧基基团，其中烷基取代基团含有1至约3个碳原子，β-单氨基杂环基乙氧基基团，或其药用可接受盐；R.sub.3是氢原子，或含有1至约3个碳原子的烷基基团；R.sub.4是氢原子，醋酸基团，羟基，或烷氧基，其中烷基取代基团含有1至约3个碳原子。
• Cyclopropyl analogs as anti-estrogenic, anti-tumor and female fertility
  申请人：The Board of Regents for the University of Oklahoma

  公开号：US04879315A1

  公开（公告）日：1989-11-07

  Anti-estrogenic cyclopropyl analogs such as 1,1-dichlorocis-2,3-diphenylcyclopropane, when administered to a subject function as anti-tumor agents to prevent the development of estrogen-dependent tumors in the subject and substantially arrest the growth and metastatic involvement of existing estrogen-dependent tumors in the subject. Further, the anti-estrogenic cyclopropyl analogs may be used as anti-estrogenic agents and as fertility agents in the treatment of female infertility. The cyclopropyl analogs useful as anti-tumor, anti-estrogenic and female fertility agents have the general structure ##STR1## wherein: X is a halogen or hydrogen atom; R.sub.1 is a hydrogen atom, an alkyl group containing from 1 to about 3 carbon atoms, a monocyclic group, a hydroxy substituted monocyclic group, an alkoxy substituted monocyclic group in which the alkyl substituent contains from 1 to about 3 carbon atoms or an acetoxy substituted monocyclic group; R.sub.2 is a hydrogen atom, an acetate group, a hydroxyl group, an alkoxy group in which the alkyl substituent contains from 1 to about 3 carbon atoms, a beta-dialkylaminoethoxy group wherein the alkyl substituent contains from 1 to about 6 carbon atoms, a beta-monoaminoheterocycloethoxy group, or pharmaceutically acceptable salts thereof; R.sub.3 is a hydrogen atom, an acetate group, a hydroxyl group, or an alkoxy group in which the alkyl substituent contains from 1 to about 3 carbon atoms; R.sub.4 is a hydrogen atom, or an alkyl group containing from 1 to about 3 carbon atoms; and the wavy lines ( ) in the structure indicate that the anti-tumor agent can be the cis- or trans-isomers.

  抗雌激素环丙基类似物，如1,1-二氯顺-2,3-二苯基环丙烷，当用于患者时，可作为抗肿瘤剂，预防患者发生雌激素依赖性肿瘤，并且显著抑制患者现有的雌激素依赖性肿瘤的生长和转移。此外，抗雌激素环丙基类似物可用作抗雌激素剂和女性不孕症治疗中的生育剂。作为抗肿瘤、抗雌激素和女性生育剂有用的环丙基类似物具有以下通用结构：##STR1##其中：X是卤素或氢原子；R.sub.1是氢原子、含有1至约3个碳原子的烷基、单环基、羟基取代的单环基、烷氧基取代的单环基，其中烷基取代物含有1至约3个碳原子，或乙酰氧基取代的单环基；R.sub.2是氢原子、乙酸酯基、羟基、烷氧基，其中烷基取代物含有1至约3个碳原子、β-二烷基氨基乙氧基，其中烷基取代物含有1至约6个碳原子、β-单氨基杂环环丙氧基，或其药学上可接受的盐；R.sub.3是氢原子、乙酸酯基、羟基或烷氧基，其中烷基取代物含有1至约3个碳原子；R.sub.4是氢原子或含有1至约3个碳原子的烷基；结构中的波浪线（）表示抗肿瘤剂可以是顺式异构体或反式异构体。
• Zinc-promoted reactions. 6. The reduction of diphenylcyclopropenone in acidic media.
  作者：Maria Luisa Di Vona、Vittorio Rosnati

  DOI：10.1016/s0040-4020(01)80246-5

  日期：1993.1

  The reduction of diphenylcyclopropenone with zinc was investigated under a variety of conditions. The product distribution can be explained in terms of a general mechanism for zinc-promoted reductions.
• Kostikov; Varakin; Molchanov, Russian Journal of Organic Chemistry, 1996, vol. 32, # 3, p. 348 - 352
  作者：Kostikov、Varakin、Molchanov、Ogloblin

  DOI：——

  日期：——
• KOSTIKOV, R. R.;VARAKIN, G. S.;OGLOBLIN, K. A., ZH. ORGAN. XIMII, 1983, 19, N 8, 1625-1632
  作者：KOSTIKOV, R. R.、VARAKIN, G. S.、OGLOBLIN, K. A.

  DOI：——

  日期：——