2-tert-butyl-4-cyanomethyloxazole | 198075-83-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-tert-butyl-4-cyanomethyloxazole
• 英文别名: 2-(2-tert-Butyl-1,3-oxazol-4-yl)acetonitrile
• CAS: 198075-83-1
• 化学式: C₉H₁₂N₂O
• 分子量: 164.207
• InChiKey: TVCQBDQBYBMYGN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  12
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  49.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3,5-dichloro-1-methylpyrazole-4-carboxylic acid chloride 、 2-tert-butyl-4-cyanomethyloxazole 在 potassium tert-butylate 作用下， 以 四氢呋喃 为溶剂， 生成 2-{2-tert-butyloxazol-4-yl}-3-(3,5-dichloro-1-methyl-pyrazol-4-yl)-3-hydroxyacrylonitrile
  参考文献：
  名称：

  US6063734

  摘要：

  公开号：
• 作为产物：
  描述：

  2-叔丁基-4-(氯甲基)-1,3-恶唑 在 sodium hydroxide 作用下， 以 二甲基亚砜 为溶剂， 生成 2-tert-butyl-4-cyanomethyloxazole
  参考文献：
  名称：

  US6063734

  摘要：

  公开号：

文献信息

• Etylene derivatives and pesticides containing said derivatives
  申请人：Nissan Chemical Industries, Ltd.

  公开号：US20030216394A1

  公开（公告）日：2003-11-20

  Ethylene derivatives of formula (I): 1 where Q is an unsubstituted or substituted phenyl or heterocyclic group, especially a 4-thiazolyl, 1- or 3-pyrazolyl, 1,3-oxazol-4-yl, phenyl or pyridyl group; E is a substituent such as a cyano group; A is a substituent such as a 4-pyrazolyl or thiazolyl group; and B is a substituent such as an alkylcarbonyl group. Agricultural chemicals and agents for preventing the attachment of aquatic organisms containing one or more such ethylene derivatives.

  公式（I）的乙烯衍生物：1其中Q是未取代或取代的苯基或杂环基团，特别是4-噻唑基，1-或3-吡唑基，1,3-噁唑-4-基，苯基或吡啶基；E是如氰基等的取代基；A是如4-吡唑基或噻唑基等的取代基；B是如烷基羰基基团等的取代基。含有一个或多个这样的乙烯衍生物的农药化学品和防止水生生物附着的制剂。
• Ethylene derivatives and pesticides containing said derivatives
  申请人：Nissan Chemical Industries, Ltd.

  公开号：US06462049B1

  公开（公告）日：2002-10-08

  Ethylene derivatives of formula (I): where Q is an unsubstituted or substituted phenyl or heterocyclic group, especially a 4-thiazolyl, 1- or 3-pyrazolyl, 1,3-oxazol-4-yl, phenyl or pyridyl group; E is a substituent such as a cyano group; A is a substituent such as a 4-pyrazolyl or thiazolyl group; and B is a substituent such as an alkylcarbonyl group. Agricultural chemicals and agents for preventing the attachment of aquatic organisms containing one or more such ethylene derivatives.

  式（I）的乙烯衍生物：其中Q是未取代或取代的苯基或杂环基团，特别是4-噻唑基，1-或3-吡唑基，1,3-噁唑-4-基，苯基或吡啶基；E是氰基等取代基；A是4-吡唑基或噻唑基等取代基；B是烷基羰基基团等取代基。含有一种或多种此类乙烯衍生物的农业化学品和防止水生生物附着的剂。
• ETHYLENE DERIVATIVES AND PEST CONTROLLING AGENTS
  申请人：NISSAN CHEMICAL INDUSTRIES, LIMITED

  公开号：EP0913392A1

  公开（公告）日：1999-05-06

  Ethylene derivatives of formula (I): where Q is an unsubstituted or substituted phenyl or heterocyclic group, especially a 4-thiazolyl, 1- or 3-pyrazolyl, 1,3-oxazol-4-yl, phenyl or pyridyl group; E is a substituent such as a cyano group; A is a substituent such as a 4-pyrazolyl or thiazolyl group; and B is a substituent such as an alkylcarbonyl group. Agricultural chemicals and agents for preventing the attachment of aquatic organisms containing one or more such ethylene derivatives.

  式(I)的乙烯衍生物： 其中 Q 是未取代或取代的苯基或杂环基团，特别是 4-噻唑基、1-或 3-吡唑基、1,3-恶唑-4-基、苯基或吡啶基；E 是取代基，如氰基；A 是取代基，如 4-吡唑基或噻唑基；B 是取代基，如烷基羰基。含有一种或多种此类乙烯衍生物的农用化学品和防止水生生物附着的制剂。
• 2,3-cyclic substituted derivatives of 3-hydroxyacrolein and 3-hydroxyacrylic acid as pesticides
  申请人：NISSAN CHEMICAL INDUSTRIES, LIMITED

  公开号：EP1360901A1

  公开（公告）日：2003-11-12

  Ethylene derivatives of formula (I): where Q is an unsubstituted or substituted phenyl or heterocyclic group, especially a 4-thiazolyl, 1- or 3-pyrazolyl, 1,3-oxazol-4-yl, phenyl or pyridyl group; E is a substituent having a carbonyl group; A is a substituent such as a 4-pyrazolyl or thiazolyl group; and B is a substituent such as an alkylcarbonyl group. Agricultural chemicals and agents for preventing the attachment of aquatic organisms containing one or more such ethylene derivatives.

  式(I)的乙烯衍生物： 其中 Q 是未取代或取代的苯基或杂环基团，特别是 4-噻唑基、1-或 3-吡唑基、1,3-恶唑-4-基、苯基或吡啶基；E 是具有羰基的取代基；A 是取代基，如 4-吡唑基或噻唑基；B 是取代基，如烷基羰基。含有一种或多种此类乙烯衍生物的农用化学品和防止水生生物附着的制剂。
• USRE038188E1
  申请人：——

  公开号：——

  公开（公告）日：——