4,5-二氯-1-羟基甲基咪唑 | 119552-43-1

• 分子结构分类: 有机化合物 - 有机卤素化合物 - 芳基卤化物
• 中文名称: 4,5-二氯-1-羟基甲基咪唑
• 英文名称: 1-hydroxymethyl-4,5-dichloroimidazole
• 英文别名: 4,5-Dichloro-1-hydroxymethylimidazole；(4,5-dichloroimidazol-1-yl)methanol
• CAS: 119552-43-1
• 化学式: C₄H₄Cl₂N₂O
• 分子量: 166.995
• InChiKey: VLNRTXUSGVSYRD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  9
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  38
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  4,5-二氯-1-羟基甲基咪唑 、 氯化亚砜 以77%的产率得到
  参考文献：
  名称：

  BUERSTINGHAUS, RAINER;NEUBAUER, HANS-JUERGEN;HOFMEISTER, PETER;KUENAST, C+

  摘要：

  DOI：

文献信息

• N-substituted azoles and insecticide, arachnicide, and nematocide
  申请人：BASF Aktiengesellschaft

  公开号：US04943585A1

  公开（公告）日：1990-07-24

  ##STR1## N-substituted azoles of the formula I where R.sup.1, R.sup.2, R.sup.3 are each hydrogen, halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.8 -alkoxy, C.sub.1 -C.sub.4 -haloalkyl, C.sub.1 -C.sub.4 -haloalkoxy, C.sub.3 -C.sub.10 -cycloalkyl, nitro or cyano, Q is an unsubstituted or substituted azole group of the formula IIa-IIf ##STR2## R.sup.4 to R.sup.15 denoting hydrogen, halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.4 -haloalkyl, C.sub.1 -C.sub.4 -alkoxy, C.sub.3 -C.sub.10 -cycloalkyl or aryl which is unsubstituted or mono- di- or trisubstituted by halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.8 -alkoxy, C.sub.1 -C.sub.4 -haloalkyl or C.sub.1 -C.sub.4 -haloalkoxy, and X is, in the case of the azole group IIa, --CH.sub.2 -- or -O(CH.sub.2).sub.n --, n being one of the integers 1, 2 or 3, or, in the case of the azole groups IIb-IIf, --OCH.sub.2 --, pesticides containing compounds I as active ingredients, and a process for combating pests.

  式I的N-取代咪唑化合物，其中R.sup.1、R.sup.2、R.sup.3分别为氢、卤素、C.sub.1 -C.sub.8 -烷基、C.sub.1 -C.sub.8 -氧基、C.sub.1 -C.sub.4 -卤代烷基、C.sub.1 -C.sub.4 -卤代氧基、C.sub.3 -C.sub.10 -环烷基、硝基或氰基，Q为式IIa-IIf的未取代或取代咪唑基团 ##STR2## 其中R.sup.4至R.sup.15表示氢、卤素、C.sub.1 -C.sub.8 -烷基、C.sub.1 -C.sub.4 -卤代烷基、C.sub.1 -C.sub.4 -氧基、C.sub.3 -C.sub.10 -环烷基或芳基，该芳基未取代或经卤素、C.sub.1 -C.sub.8 -烷基、C.sub.1 -C.sub.8 -氧基、C.sub.1 -C.sub.4 -卤代烷基或C.sub.1 -C.sub.4 -卤代氧基的单取代、双取代或三取代，X为，在咪唑基IIa的情况下，--CH.sub.2 --或-O(CH.sub.2).sub.n --，n为整数1、2或3之一，或在咪唑基IIb-IIf的情况下，--OCH.sub.2 --，含有化合物I作为活性成分的杀虫剂，以及用于防治害虫的方法。
• N-phenoxyphenoxymethyl-triazoles and a method for controlling pests
  申请人：BASF Aktiengesellschaft

  公开号：US05187182A1

  公开（公告）日：1993-02-16

  N-substituted azoles of the formula I ##STR1## where R.sup.1,R.sup.2, R.sup.3 are each hydrogen, halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.8 -alkoxy, C.sub.1 -C.sub.4 -haloalkyl, C.sub.1 -C.sub.4 -haloalkoxy, C.sub.3 -C.sub.10 -cycloalkyl, nitro or cyano, Q is an unsubstituted or substituted azole group of the formulae IIa-IIf ##STR2## R.sup.4 to R.sup.15 denoting hydrogen, halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.4 -haloalkyl, C.sub.1 -C.sub.4 -alkoxy, C.sub.3 -C.sub.10 -cycloalkyl or aryl which is unsubstituted or mono-, di- or trisubstituted by halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.8 -alkoxy, C.sub.1 -C.sub.4 -haloalkyl or C.sub.1 -C.sub.4 -haloalkoxy, and X is, in the case of the azole group IIa, --CH.sub.2 -- or --O(CH.sub.2).sub.n --, n being one of the integers 1, 2 or 3, or, in the case of the azole groups IIb-IIf, --OCH.sub.2 --, pesticides containing compounds I as active ingredients, and a process for combating pests.

  式I中，N-取代咪唑化合物的结构为：##STR1## 其中，R.sup.1、R.sup.2和R.sup.3分别代表氢、卤素、C.sub.1-C.sub.8烷基、C.sub.1-C.sub.8氧烷基、C.sub.1-C.sub.4卤代烷基、C.sub.1-C.sub.4卤代氧烷基、C.sub.3-C.sub.10环烷基、硝基或氰基；Q代表未取代或取代的咪唑基，其结构为式IIa-IIf：##STR2## 其中，R.sup.4至R.sup.15代表氢、卤素、C.sub.1-C.sub.8烷基、C.sub.1-C.sub.4卤代烷基、C.sub.1-C.sub.4氧烷基、C.sub.3-C.sub.10环烷基或苯基，苯基可以未取代或单、二或三取代，取代基为卤素、C.sub.1-C.sub.8烷基、C.sub.1-C.sub.8氧烷基、C.sub.1-C.sub.4卤代烷基或C.sub.1-C.sub.4卤代氧烷基。X在咪唑基IIa中为--CH.sub.2--或--O(CH.sub.2).sub.n--，其中n为1、2或3的整数，在咪唑基IIb-IIf中为--OCH.sub.2--。含有式I化合物作为活性成分的杀虫剂以及一种用于防治害虫的方法。
• N-phenoxphenyloxymethyl substituted azoles and method for controlling
  申请人：BASF Aktiengesellschaft

  公开号：US05185359A1

  公开（公告）日：1993-02-09

  N-substituted azoles of the formula I ##STR1## where R.sup.1, R.sup.2, R.sup.3 are each hydrogen, halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.8 -alkoxy, C.sub.1 -C.sub.4 -haloalkyl, C.sub.1 -C.sub.4 -haloalkoxy, C.sub.3 -C.sub.10 -cycloalkyl, nitro or cyano, Q is an unsubstituted or substituted azole group of the formulae IIa-IIf ##STR2## R.sup.4 to R.sup.15 denoting hydrogen, halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.4 -haloalkyl, C.sub.1 -C.sub.4 -alkoxy, C.sub.3 -C.sub.10 -cycloalkyl or aryl which is unsubstituted or mono-, di- or trisubstituted by halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.8 -alkoxy, C.sub.1 -C.sub.4 -haloalkyl or C.sub.1 -C.sub.4 -haloalkoxy, and X is, in the case of the azole group IIa, --CH.sub.2 -- or --O(CH.sub.2).sub.n --, n being one of the integers 1, 2 or 3, or, in the case of the azole groups IIb-IIf, --OCH.sub.2 --, pesticides containing compounds I as active ingredients, and a process for combating pests.

  公式I中的N-取代的咪唑化合物，其中R1、R2、R3分别为氢、卤素、C1-C8烷基、C1-C8烷氧基、C1-C4卤代烷基、C1-C4卤代烷氧基、C3-C10环烷基、硝基或氰基，Q为未取代或取代的咪唑基，公式为IIa-IIf： 其中R4至R15分别表示氢、卤素、C1-C8烷基、C1-C4卤代烷基、C1-C4烷氧基、C3-C10环烷基或未取代或单、双或三取代的芳基，取代基为卤素、C1-C8烷基、C1-C8烷氧基、C1-C4卤代烷基或C1-C4卤代烷氧基。X在咪唑基IIa的情况下为--CH2--或--O(CH2)n--，其中n为1、2或3的整数，在咪唑基IIb-IIf的情况下为--OCH2--。含有I化合物作为活性成分的杀虫剂以及用于防治害虫的方法。
• Phenoxyphenylmethyl substituted azoles and pesticidal composition thereof
  申请人：BASF Aktiengesellschaft

  公开号：US05214064A1

  公开（公告）日：1993-05-25

  N-substituted azoles of the formula I ##STR1## where R.sup.1, R.sup.2, R.sup.3 are each hydrogen, halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.8 -alkoxy, C.sub.1 -C.sub.4 -haloalkyl, C.sub.1 -C.sub.4 -haloalkoxy, C.sub.3 -C.sub.10 -cycloalkyl, nitro or cyano, Q is an unsubstituted or substituted azole group of the formulae IIa-IIf ##STR2## R.sup.4 to R.sup.15 denoting hydrogen, halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.4 -haloalkyl, C.sub.1 -C.sub.4 -alkoxy, C.sub.3 -C.sub.10 -cycloalkyl or aryl which is unsubstituted or mono-, di- or trisubstituted by halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.8 -alkoxy, C.sub.1 -C.sub.4 -haloalkyl or C.sub.1 -C.sub.4 -haloalkoxy, and X is, in the case of the azole group IIa, --CH.sub.2 -- or --O(CH.sub.2).sub.n --, n being one of the integers 1, 2 or 3, or, in the case of the azole groups IIb-IIf, pesticides containing compounds I as active ingredients, and a process for combating pests.

  化合物I的N-取代咪唑式为##STR1## 其中R.sup.1，R.sup.2，R.sup.3分别为氢，卤素，C.sub.1-C.sub.8-烷基，C.sub.1-C.sub.8-烷氧基，C.sub.1-C.sub.4-卤代烷基，C.sub.1-C.sub.4-卤代烷氧基，C.sub.3-C.sub.10-环烷基，硝基或氰基，Q是未取代或取代的咪唑基式IIa-IIf之一##STR2## R.sup.4到R.sup.15表示氢，卤素，C.sub.1-C.sub.8-烷基，C.sub.1-C.sub.4-卤代烷基，C.sub.1-C.sub.4-烷氧基，C.sub.3-C.sub.10-环烷基或苯基，其未取代或单，二或三位被卤素，C.sub.1-C.sub.8-烷基，C.sub.1-C.sub.8-烷氧基，C.sub.1-C.sub.4-卤代烷基或C.sub.1-C.sub.4-卤代烷氧基取代，X在咪唑基IIa的情况下为--CH.sub.2--或--O(CH.sub.2).sub.n--，其中n是整数1、2或3，在咪唑基IIb-IIf的情况下为杀虫剂，含有化合物I作为活性成分，以及一种用于防治害虫的方法。
• N-phenoxyphenyloxymethyl substituted azoles and method for controlling
  申请人：BASF Aktiengesellschaft

  公开号：US05280036A1

  公开（公告）日：1994-01-18

  N-substituted azoles of the formula I ##STR1## where R.sup.1, R.sup.2, R.sup.3 are each hydrogen, halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.8 -alkoxy, C.sub.1 -C.sub.4 -haloalkyl, C.sub.1 -C.sub.4 -haloalkoxy, C.sub.3 -C.sub.10 -cycloalkyl, nitro or cyano, Q is an unsubstituted or substituted azole group of the formulae IIa-IIf ##STR2## R.sup.4 to R.sup.15 denoting hydrogen, halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.4 -haloalkyl, C.sub.1 -C.sub.4 -alkoxy, C.sub.3 -C.sub.10 -cycloalkyl or aryl which is unsubstituted or mono-, di- or trisubstituted by halogen, C.sub.1 -C.sub.8 -alkyl, C.sub.1 -C.sub.8 -alkoxy, C.sub.1 -C.sub.4 -haloalkyl or C.sub.1 -C.sub.4 -haloalkoxy, and X is, in the case of the azole group IIa, --CH.sub.2 -- or --O(CH.sub.2).sub.n --, n being one of the integers 1, 2 or 3, or, in the case of the azole groups IIb-IIf, --OCH.sub.2 --, pesticides containing compounds I as active ingredients, and a process for combating pests.

  式I中，N-取代的唑类化合物，其中R1、R2、R3分别为氢、卤素、C1-C8烷基、C1-C8烷氧基、C1-C4卤代烷基、C1-C4卤代烷氧基、C3-C10环烷基、硝基或氰基，Q为未取代或取代的唑基，其式为IIa-IIf，式中R4至R15分别表示氢、卤素、C1-C8烷基、C1-C4卤代烷基、C1-C4烷氧基、C3-C10环烷基或芳基，该芳基为未取代或单、二或三取代的卤素、C1-C8烷基、C1-C8烷氧基、C1-C4卤代烷基或C1-C4卤代烷氧基，X在唑基IIa中为--CH2--或--O(CH2)n--，其中n为1、2或3的整数，在唑基IIb-IIf中为--OCH2--，含有化合物I作为活性成分的杀虫剂，以及用于防治害虫的方法。