(4-chloro-phenyl)-prop-2-ynyloxy-acetic acid methyl ester | 663918-51-2

• 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: (4-chloro-phenyl)-prop-2-ynyloxy-acetic acid methyl ester
• 英文别名: 2-(2-propynyloxy)-2-(4-chlorophenyl)acetic acid methyl ester；Methyl 2-(4-chlorophenyl)-2-prop-2-ynoxyacetate
• CAS: 663918-51-2
• 化学式: C₁₂H₁₁ClO₃
• 分子量: 238.671
• InChiKey: UCYGQNUBKGUETB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  16
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  (4-chloro-phenyl)-prop-2-ynyloxy-acetic acid methyl ester 在 lithium hydroxide monohydrate 作用下， 以 四氢呋喃 、 甲醇 、 水 为溶剂， 以87 %的产率得到2-(4-chlorophenyl)-2-(prop-2-yn-1-yloxy)acetic acid
  参考文献：
  名称：

  Synthesis of Crop Protection Agent Mandipropamid

  摘要：

  DOI：

  10.56042/ijc.v62i9.3120
• 作为产物：
  描述：

  对氯苯乙酮 在 selenium(IV) oxide 、 potassium carbonate 、 对甲苯磺酸 、 ytterbium(III) triflate 作用下， 以 1,4-二氧六环 、 水 、 乙腈 为溶剂， 反应 45.25h， 生成 (4-chloro-phenyl)-prop-2-ynyloxy-acetic acid methyl ester
  参考文献：
  名称：

  Synthesis of Crop Protection Agent Mandipropamid

  摘要：

  DOI：

  10.56042/ijc.v62i9.3120

文献信息

• PHENYLPYRIDINE COMPOUND AND BACTERICIDAL COMPOSITION CONTAINING THE SAME
  申请人：Sumitomo Chemical Company, Limited

  公开号：EP1541557A1

  公开（公告）日：2005-06-15

  A phenylpyridine compound represented by the formula has an excellent controlling activity against plant diseases: [, wherein, in the formula, R1, R2, R3, R4 and R5 independently represent a hydrogen atom, a halogen atom and the like; R6 represents a hydrogen atom or a C1-C3 alkyl group; R7, R8 and R11 independently represent a hydrogen atom, a halogen atom and the like; R9 and R10 independently represent a hydroxyl group and the like; W1―W2=W3 ―W4 represents N―CH=CH―CH and the like; X represents an oxygen atom and the like; and Q represents a (C1-C6 alkoxy)methylene and the like].

  该式代表的苯基吡啶化合物对植物病害具有优异的控制活性: [其中，在该式中，R1、R2、R3、R4和R5分别代表氢原子、卤原子等; R6代表氢原子或C1-C3烷基; R7、R8和R11分别代表氢原子、卤原子等; R9和R10分别代表羟基等; W1―W2=W3―W4代表N―CH=CH―CH等; X代表氧原子等; Q代表(C1-C6烷氧基)亚甲基等]。
• Phenylpyridine compound and fungicidal compostion containing the same
  申请人：Komori Takashi

  公开号：US20060041144A1

  公开（公告）日：2006-02-23

  A phenylpyridine compound represented by the formula has an excellent controlling activity against plant diseases: [, wherein, in the formula, R 1 , R 2 , R 3 , R 4 and R 5 independently represent a hydrogen atom, a halogen atom and the like; R 6 represents a hydrogen atom or a C1-C3 alkyl group; R 7 , R 8 and R 11 independently represent a hydrogen atom, a halogen atom and the like; R 9 and R 10 independently represent a hydroxyl group and the like; W 1 —W 2 ═W 3 —W 4 represents N—CH═CH—CH and the like; X represents an oxygen atom and the like; and Q represents a (C1-C6 alkoxy)methylene and the like].

  一种苯基吡啶化合物，其化学式如下，在该式中，R1、R2、R3、R4和R5独立地表示氢原子、卤素原子等；R6表示氢原子或C1-C3烷基；R7、R8和R11独立地表示氢原子、卤素原子等；R9和R10独立地表示羟基等；W1-W2═W3-W4表示N-CH═CH-CH等；X表示氧原子等；Q表示(C1-C6烷氧基)亚甲基等。该化合物对植物病害具有优异的控制活性。
• Process for the Synthesis of Mandipropamid and Derivatives Thereof
  申请人：Bowden Martin Charles

  公开号：US20090118532A1

  公开（公告）日：2009-05-07

  A process for the preparation of a compound of formula (I) wherein: R is an alkynyl group; R 1 is alkyl, alkenyl, alkynyl, cycloalkyl, cycloalkyl-alkyl, phenyl and phenylalkyl, it being possible in turn for all of the receding groups to carry one or more identical or different halogen atoms; alkoxy; alkenyloxy; alkynyloxy; alkoxyalkyl; haloalkoxy; alkylthio; haloalkylthio; alkysulfonyl; formyl; alkanoyl; hydroxy; halogen; cyano; nitro; amino; alkylamino; dialkylamino; carboxyl; alkoxycarbonyl; alkenyloxycarbonyl; or alkynyloxycarbonyl; and n is an integer from 0 to 3, said process comprising: (i) the reaction of a compound of formula (III) wherein R, R 1 and n are as hereinbefore defined; m and m′ are independently 0 or 1; when m and m′ are both 0, A is an alkyl, alkenyl or alkynyl group (suitably having up to eight carbon atoms), optionally substituted by one or more groups independently selected from halogen, hydroxy, alkoxy, C 1-4 dialkylamino or cyano; when one of m and m′ is 0 and the other is 1, A is an alkanediyl, alkenediyl or alkynediyl group containing at least two carbon atoms (and suitably having up to eight carbon atoms), optionally substituted by one or more groups independently selected from halogen, hydroxy, alkoxy, C 1-4 dialkylamino or cyano; when m and m′ are both 1, A is an alkanetriyl, alkenetriyl or alkynetriyl group containing at least three carbon atoms (and suitably having up to eight carbon atoms), optionally substituted by one or more groups independently selected from halogen, hydroxy, alkoxy, C 1-4 dialkylamino or cyano; and wherein if the group A contains three or more carbon atoms, one or more of the carbon atoms may each optionally be replaced with an oxygen atom, provided that there is at least one carbon atom between any two oxygen atoms in the molecule, with a compound of formula (IV) to give a compound of formula (II) wherein R, R 1 and n are as hereinbefore defined, and (ii) the reaction of a compound of formula (II) with, wherein L is a leaving group, to give the compound of formula (I) as hereinbefore defined, is disclosed.

  一种制备式（I）化合物的方法，其中：R是炔基；R1是烷基，烯基，炔基，环烷基，环烷基-烷基，苯基和苯基烷基，这些基团中的所有基团都可以轮流携带一个或多个相同或不同的卤素原子；烷氧基；烯氧基；炔氧基；烷氧基烷基；卤代烷氧基；烷基硫醇；卤代烷基硫醇；烷基磺酰基；甲酰基；烷酰基；羟基；卤素；氰基；硝基；氨基；烷基氨基；二烷基氨基；羧基；烷氧羰基；烯氧羰基；或炔氧羰基；n是0到3的整数，该方法包括：（i）将式（III）化合物与式（IV）化合物反应，其中R，R1和n如上定义；m和m′独立地为0或1；当m和m′都为0时，A是烷基，烯基或炔基（适当地具有多达八个碳原子），可选地被一个或多个独立选择的基团取代，这些基团选择自卤素，羟基，烷氧基，C1-4二烷基氨基或氰基；当m和m′中有一个为0且另一个为1时，A是至少含有两个碳原子（适当地具有多达八个碳原子）的烷二基，烯二基或炔二基，可选地被一个或多个独立选择的基团取代，这些基团选择自卤素，羟基，烷氧基，C1-4二烷基氨基或氰基；当m和m′都为1时，A是至少含有三个碳原子（适当地具有多达八个碳原子）的烷三基，烯三基或炔三基，可选地被一个或多个独立选择的基团取代，这些基团选择自卤素，羟基，烷氧基，C1-4二烷基氨基或氰基；如果基团A含有三个或更多的碳原子，则其中一个或多个碳原子可以被氧原子替换，前提是分子中任何两个氧原子之间至少有一个碳原子，在反应后得到式（II）化合物，其中R，R1和n如上定义；（ii）将式（II）化合物与L是离去基团的化合物反应，得到如上定义的式（I）化合物。
• WO2007/20381
  申请人：——

  公开号：——

  公开（公告）日：——
• PROCESS FOR THE SYNTHESIS OF MANDIPROPAMID AND DERIVATIVES THEREOF
  申请人：Syngenta Participations AG

  公开号：EP1919857A2

  公开（公告）日：2008-05-14