2-(4-chlorophenyl-ethenyl)-2-tert.-butyl-oxirane | 80443-62-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-(4-chlorophenyl-ethenyl)-2-tert.-butyl-oxirane
• 英文别名: 2-tert-butyl-2-[2-(4-chlorophenyl)ethenyl]oxirane
• CAS: 80443-62-5
• 化学式: C₁₄H₁₇ClO
• 分子量: 236.741
• InChiKey: DTUIIKPDQHXARB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  12.5
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  1H-1,2,4-三唑 、 2-(4-chlorophenyl-ethenyl)-2-tert.-butyl-oxirane 以 乙醇 为溶剂， 生成 1-(4-chlorophenyl)-4,4-dimethyl-3-(imidazol-1-yl-methyl)-1-penten-3-ol
  参考文献：
  名称：

  Antimicrobial azoles

  摘要：

  该发明涉及式(I)的1-羟乙基-唑衍生物的组合形式，并包括将这种组合物用作抗微生物剂的用途。

  公开号：

  US04652579A1

文献信息

• 1-Hydroxyethyl-azole compounds and agricultural compositions
  申请人：Bayer Aktiengesellschaft

  公开号：US04904298A1

  公开（公告）日：1990-02-27

  New 1-hydroxyethyl-azole derivatives of the general formula ##STR1## in which R represents an alkyl radical, an optionally substituted cycloalkyl radical or an optionally substituted phenyl radical, X represents a nitrogen atom or a CH group, Y represents a grouping --OCH.sub.2 --, --CH.sub.2 CH.sub.2 -- or --CH.dbd.CH--, Z represents a halogen atom, an alkyl, cycloalkyl, alkoxy, alkylthio, halogenoalkyl, halogenoalkoxy or halogenoalkylthio radical, an optionally substituted phenyl radical, an optionally substituted phenoxy radical, an optionally substituted phenylalkyl radical or an optionally substituted phenylalkoxy radical and m is 0, 1, 2 or 3, a process for their preparation and their use as plant growth regulators and fungicides.

  新的1-羟乙基唑衍生物的一般式为##STR1##其中R代表烷基基团，可选择置换的环烷基基团或可选择置换的苯基基团，X代表氮原子或CH基团，Y代表基团--OCH.sub.2 --，--CH.sub.2 CH.sub.2 --或--CH.dbd.CH--，Z代表卤素原子，烷基，环烷基，烷氧基，烷硫基，卤代烷基，卤代烷氧基或卤代烷硫基基团，可选择置换的苯基基团，可选择置换的苯氧基基团，可选择置换的苯基烷基基团或可选择置换的苯基烷氧基基团，m为0、1、2或3，其制备方法以及它们作为植物生长调节剂和杀菌剂的用途。
• Synergistic compositions for inhibiting plant growth
  申请人：Bayer Aktiengesellschaft

  公开号：US04911750A1

  公开（公告）日：1990-03-27

  A plant growth-inhibiting composition comprising ##STR1## wherein the various radicals are as defined.

  一种植物生长抑制组合物，包括##STR1##其中各基团的定义如下。
• 1-hydroxyethyl-azole compounds and agricultural compositions
  申请人：Bayer Aktiengesellschaft

  公开号：US04723984A1

  公开（公告）日：1988-02-09

  New 1-hydroxyethyl-azole derivatives of the general formula ##STR1## in which R represents an alkyl radical, an optionally substituted cycloalkyl radical or an optionally substituted phenyl radical, X represents a nitrogen atom or a CH group, Y represents a grouping --OCH.sub.2 --, -- CH.sub.2 CH.sub.2 -- or --CH.dbd.CH--, Z represents a halogen atom, an alkyl, cycloalkyl, alkoxy, alkylthio, halogenoalkyl, halogenoalkoxy or halogenoalkylthio radical, an optionally substituted phenyl radical, an optionally substituted phenoxy radical, an optionally substituted phenylalkyl radical or an optionally substituted phenylalkoxy radical and m is 0, 1, 2 or 3, a process for their preparation and their use as plant growth regulators and fungicides.

  新的1-羟乙基-唑类衍生物的一般式为##STR1##其中，R代表烷基基团、可选取代的环烷基团或可选取代的苯基团，X代表氮原子或CH基团，Y代表基团--OCH.sub.2 --、-- CH.sub.2 CH.sub.2 --或--CH.dbd.CH--，Z代表卤素原子、烷基、环烷基、烷氧基、烷硫基、卤代烷基、卤代烷氧基或卤代烷硫基基团、可选取代的苯基团、可选取代的苯氧基团、可选取代的苯基烷基团或可选取代的苯基烷氧基团，m为0、1、2或3，一种制备它们的方法以及它们作为植物生长调节剂和杀菌剂的用途。
• Oxirane compounds
  申请人：Bayer Aktiengesellschaft

  公开号：US04532341A1

  公开（公告）日：1985-07-30

  Oxirane compounds of the formula ##STR1## in which R represents tert-butyl, iso-propyl radical, cyclopropyl, substituted cyclopropyl, cyclopentyl or substituted cyclopentyl, cyclohexyl or substituted cyclohexyl, in each case the substituent being selected from methyl, or phenyl which is optionally mono or di-substituted by identical or different substituents selected from fluorine, chlorine, methyl and trifluoromethyl, Y represents a grouping --OCH.sub.2 --, each Z is individually selected from the group consisting of a fluorine, chlorine or bromine atom, methyl, tert-butyl, cyclohexyl, methoxy, methylthio, trifluoromethyl, trifluoromethoxy, trifluoromethylthio, phenyl, phenoxy, benzyl and benzyloxy, said phenyl, phenoxy, benzyl and benzyloxy being optionally mono or di-substituted by identical or different substituents selected from fluorine, chlorine and methyl, m is 0, 1, 2 or 3; these compounds are particularly useful as intermediates for compounds used in agricultural compositions as plant growth regulants.

  式为##STR1## 的环氧化合物，其中R代表叔丁基、异丙基基团、环丙基、取代环丙基、环戊基或取代环戊基、环己基或取代环己基，其中取代基从甲基或苯基中选择，苯基可选单取代或双取代，取代基为氟、氯、甲基和三氟甲基中的相同或不同基团；Y代表--OCH.sub.2--基团；每个Z分别选自氟、氯或溴原子、甲基、叔丁基、环己基、甲氧基、甲硫基、三氟甲基、三氟甲氧基、三氟甲硫基、苯基、苯氧基、苄基和苄氧基中的一种；其中所述的苯基、苯氧基、苄基和苄氧基可选单取代或双取代，取代基为氟、氯和甲基中的相同或不同基团；m为0、1、2或3。这些化合物特别适用作用于农业组合物中的中间体，用作植物生长调节剂。
• Oxirane intermediates of 1-hydroxyethyl azole compounds
  申请人：Bayer Aktiengesellschaft

  公开号：US04626595A1

  公开（公告）日：1986-12-02

  According to the present invention 1-hydroxyethyl azole compounds are provided for in a process characterized by reacting an oxirane of the general formula ##STR1## in which R represents an alkyl radical, an optionally substituted cycloalkyl radical or an optionally substituted phenyl radical, Y represents a grouping --OCH.sub.2 --, --CH.sub.2 CH.sub.2 -- or --CH.dbd.CH--, Z represents a halogen atom, an alkyl, cycloalkyl, alkoxy, alkylthio, halogenoalkyl, halogenoalkoxy or halogenoalkylthio radical, an optionally substituted phenyl radical, an optionally substituted phenoxy radical, an optionally substituted phenylalkyl radical or an optionally substituted phenylalkoxy radical and m is 0, 1, 2 or 3, with an azole of the general formula ##STR2## in which X represents a nitrogen atom or a CH group.

  根据本发明，提供了1-羟基乙基唑类化合物的制备方法，其特征在于将一般式为##STR1##的环氧化物与一般式为##STR2##的唑类化合物反应，其中R代表烷基基团、可选取代的环烷基基团或可选取代的苯基基团，Y代表--OCH.sub.2 --、--CH.sub.2 CH.sub.2 --或--CH.dbd.CH--的基团，Z代表卤素原子、烷基、环烷基、烷氧基、烷硫基、卤代烷基、卤代烷氧基或卤代烷硫基基团、可选取代的苯基基团、可选取代的苯氧基基团、可选取代的苯基烷基基团或可选取代的苯基烷氧基基团，m为0、1、2或3，X代表氮原子或CH基团。