NRDC 157 | 55700-98-6

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: NRDC 157
• 英文别名: 3-phenoxybenzyl(1R)cis-2,2-dimethyl-3-(2,2-dibromovinyl)cyclopropane carboxylate；(3-phenoxyphenyl)methyl (1R,3R)-3-(2,2-dibromoethenyl)-2,2-dimethylcyclopropane-1-carboxylate
• CAS: 55700-98-6
• 化学式: C₂₁H₂₀Br₂O₃
• 分子量: 480.196
• InChiKey: GNJFNKNVSCTPDC-HKUYNNGSSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.6
• 重原子数：
  26
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  (1R-顺式)-3-(2,2-二溴乙烯基)-2,2-二甲基环丙烷甲酸 、 、 氯化亚砜 、 3-苯氧基苄醇 以 吡啶 、 苯 为溶剂， 以to give 3-phenoxybenzyl(1R)cis-2,2-dimethyl-3-(2,2-dibromovinyl)cyclopropane carboxylate, m.p. 93°, nD 1.5848 (Compound P29A)的产率得到NRDC 157
  参考文献：
  名称：

  Pesticides

  摘要：

  新的杀虫剂的化学式为: ##STR1## 其中R.sup.1代表氢或甲基基团; R.sup.2代表氢或卤素或低碳基基团; R.sup.3代表氢或卤素或含有至少2个碳原子的低碳氧基基团，当R.sup.2代表甲基时; 前提是(a)当R.sup.1代表甲基时，R.sup.2和R.sup.3各代表氢，(b)当R.sup.1和R.sup.3各代表氢且R.sup.2代表烷基时，该烷基含有至少2个碳原子，(c)当R.sup.3代表卤素时，R.sup.2代表氢或卤素; 而R代表一种与菊酸形成杀虫酯的基团，例如5-苄基-3-呋喃甲基，3-苯氧基苄基，.alpha.-氰基-3-苯氧基苄基。通过常规形成酯键或使用3-甲酰基或3-乙酰基-2,2-二甲基环丙烷羧酸酯化所需的残基或通过随后转化为所需的残基的烷基来制备酯。

  公开号：

  US04464391A1

文献信息

• N-Formyl phosphonamidothioates
  申请人：E.I. DU PONT DE NEMOURS AND COMPANY

  公开号：EP0322195A1

  公开（公告）日：1989-06-28

  This invention relates to certain N-formyl phosphonamidothioates, agriculturally suitable compositions containing them, and their use as insecticides, acaricides and nematocides.

  这项发明涉及某些N-甲酰磷酰氨基硫酸酯，含有它们的农业适用组合物，以及它们作为杀虫剂、杀螨剂和杀线虫剂的用途。
• Insecticides
  申请人：National Research Development Corporation

  公开号：US04024163A1

  公开（公告）日：1977-05-17

  New insecticides are of formula: ##STR1## wherein R.sup.1 represents hydrogen or a methyl group; R.sup.2 represents hydrogen or a halogeno or lower alkyl group; R.sup.3 represents hydrogen or a halogeno, lower alkyl (which is different to R.sup.2 when R.sup.2 represents a lower alkyl group) or carbo(loweralkoxy) group which contains at least 2 carbon atoms in the lower alkoxy residue when R.sup.2 represents methyl or R.sup.2 and R.sup.3 together with the carbon atom to which they are attached represent a cycloalkylene ring having at least one endocyclic carbon to carbon double bond; with the proviso that (a) R.sup.2 and R.sup.3 each represent hydrogen only when R.sup.1 represents methyl and (b) R.sup.3 contains at least 2 carbon atoms when R.sup.1 and R.sup.2 each represent hydrogen; and R represents a group which form insecticidal esters with chrysanthemic acid e.g. 5-benzyl-3-furylmethyl, 3-phenoxybenzyl, .alpha.-cyano-3-phenoxybenzyl. The esters are prepared by forming the ester linkage conventionally or by a Wittig reaction using a 3-formyl- or 3-acetyl-2,2-dimethyl cyclopropane carboxylic acid esterified with the desired residue or by an alkyl group which is subsequently converted to the desired residue.

  新的杀虫剂的化学式为：##STR1## 其中R.sup.1代表氢或甲基基团；R.sup.2代表氢或卤素或较低的烷基基团；R.sup.3代表氢或卤素、较低的烷基（当R.sup.2代表较低的烷基基团时与R.sup.2不同）或含有至少2个碳原子的羧基（较低的烷氧基）基团，当R.sup.2代表甲基或R.sup.2和R.sup.3与它们连接的碳原子一起代表至少有一个环内碳与碳的双键的环烷基烃基团；但需满足以下条件：(a)当R.sup.1代表甲基时，R.sup.2和R.sup.3各自仅代表氢；(b)当R.sup.1和R.sup.2各自代表氢时，R.sup.3含有至少2个碳原子；R代表一种基团，能够形成与菊酸杀虫酸酯的杀虫剂，例如5-苄基-3-呋喃甲基、3-苯氧基苄基、α-氰基-3-苯氧基苄基。酯类可以通过传统的酯化反应或使用3-甲酰基或3-乙酰基-2,2-二甲基环丙烷羧酸酯化所需的残基的Wittig反应来制备，或通过后续转化为所需的残基的烷基基团来制备。
• 2,2-dimethyl-3-(2-halovinyl)cyclopropane carboxlic acid ester pesticides
  申请人：National Research Development Corporation

  公开号：US04622337A1

  公开（公告）日：1986-11-11

  New insecticides are of formula: ##STR1## wherein R.sup.1 represents hydrogen or a methyl group; R.sup.2 represents hydrogen or a halogeno or lower alkyl group; R.sup.3 represents hydrogen or a halogeno or carbo(lower alkoxy) group which contains at least 2 carbon atoms in the lower alkoxy residue when R.sup.2 represents methyl; with the proviso that (a) R.sup.2 and R.sup.3 each represent hydrogen only when R.sup.1 represents methyl, (b) when R.sup.1 and R.sup.3 each represent hydrogen and R.sup.2 represents alkyl, that alkyl group contains at least 2 carbon atoms and (c) when R.sup.3 represents halogeno, R.sup.2 represents hydrogen or halogeno; and R represents a group which forms insecticidal esters with chrysanthemic acid e.g. 5-benzyl-3-furylmethyl, 3-phenoxybenzyl, .alpha.-cyano-3-phenoxybenzyl. The esters are prepared by forming the ester linkage conventionally or by a Wittig reaction using a 3-formyl- or 3-acetyl-2,2-dimethyl cyclopropane carboxylic acid esterified with the desired residue or by an alkyl group which is subsequently converted to the desired residue.

  新的杀虫剂的化学式为：##STR1## 其中，R.sup.1代表氢或甲基基团；R.sup.2代表氢或卤代或低碳基基团；R.sup.3代表氢或卤代或含有至少2个碳原子的碳基（低碳基氧）基团，当R.sup.2代表甲基时；但必须满足以下条件：(a)当R.sup.1代表甲基时，R.sup.2和R.sup.3均代表氢；(b)当R.sup.1和R.sup.3均代表氢，R.sup.2代表烷基时，该烷基含有至少2个碳原子；(c)当R.sup.3代表卤代时，R.sup.2代表氢或卤代；R代表一种与菊花酸形成杀虫酯的基团，例如5-苄基-3-呋喃甲基、3-苯氧基苄基、α-氰基-3-苯氧基苄基。这些酯可以通过常规的酯键形成或使用3-甲酰基-或3-乙酰基-2,2-二甲基环丙烷羧酸酯化所需残基的Wittig反应来制备，或通过随后转化为所需残基的烷基来制备。
• Synergistic pyrethroid formulations and their preparation
  申请人：THE WELLCOME FOUNDATION LIMITED

  公开号：EP0005826A1

  公开（公告）日：1979-12-12

  Pyrethroid esters of the formula (1) potentiate the activity of each other against arthropod pests. Values of R2 and R3 include halogen and R includes phenoxybenzyl and a-cyanophenoxybenzyl. Compositions comprise of two or more esters of (I) and formulations comprise such compositions in association with a carrier. The esters (i) are used to combat arthropods.

  式（1）的拟除虫菊酯可增强彼此对节肢动物害虫的活性。 R2 和 R3 的值包括卤素，R 包括苯氧基苄基和 a-氰基苯氧基苄基。 组合物由两种或两种以上的（I）酯组成，制剂由与载体结合的此类组合物组成。 酯（I）用于防治节肢动物。
• Insecticidal and acaricidal phenoxypyridinyl esters and intermediates
  申请人：E.I. DU PONT DE NEMOURS AND COMPANY

  公开号：EP0223521A2

  公开（公告）日：1987-05-27

  Compounds of the formula wherein R is a substituted cyclopropane ring of defined structure; X is 0 or S n is 1 to 3 m is 0 or 1 R, is H, halogen or various organic groups; R2 is H, halogen, CH3 or CF3; exhibit insecticidal and acaricidal activity. Some are active in soil. The compounds may be made by esterifying the appropriate cyclopropanecarboxylic acid with the appropriate 1-pyridyl-2,2,2-trifluoroethanol also novel per se.

  式中的化合物 其中 R 是定义结构的取代环丙烷环； X 是 0 或 S n 为 1 至 3 m 为 0 或 1 R 是 H、卤素或各种有机基团； R2 是 H、卤素、CH3 或 CF3； 具有杀虫和杀螨活性。有些在土壤中具有活性。 这些化合物可通过将适当的环丙烷羧酸与适当的 1-吡啶基-2,2,2-三氟乙醇酯化制成，这本身也是一种新颖的化合物。