1-(1,1-dimethyl-4-hydroxy-2-butynyl)-2,2,5,5-tetramethyl-1-aza-2,5-disilacyclopentane | 543690-80-8

• 分子结构分类: 有机化合物 - 有机金属化合物 - 有机类金属化合物
• 英文名称: 1-(1,1-dimethyl-4-hydroxy-2-butynyl)-2,2,5,5-tetramethyl-1-aza-2,5-disilacyclopentane
• 英文别名: (1-hydroxy-4-methylpent-2-yn-4-yl)-2,2,5,5-tetramethyl-1-aza-2,5-disilacyclopentane；4-methyl-4-(2,2,5,5-tetramethyl-[1,2,5]azadisilolidin-1-yl)-pent-2-yn-1-ol；4-methyl-4-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)pent-2-yn-1-ol
• CAS: 543690-80-8
• 化学式: C₁₂H₂₅NOSi₂
• 分子量: 255.508
• InChiKey: PUZQXRRIWPRFIE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.49
• 重原子数：
  16
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  23.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-(1,1-dimethyl-4-hydroxy-2-butynyl)-2,2,5,5-tetramethyl-1-aza-2,5-disilacyclopentane 在 盐酸 作用下， 以 水 为溶剂， 反应 0.5h， 生成 4-amino-1-hydroxy-4-methylpent-2-yne hydrochloride
  参考文献：
  名称：

  [EN] FUNGICIDES
  [FR] FONGICIDES

  摘要：

  使用一般式（1）化合物作为植物真菌杀菌剂。还包括含有这些化合物的植物杀菌剂组合物和其中的一些化合物本身。

  公开号：

  WO2004052100A1
• 作为产物：
  描述：

  1,2-双(氯二甲基硅基)乙烷 在 正丁基锂 、 三乙胺 作用下， 以 四氢呋喃 、 hexanes 、 二氯甲烷 为溶剂， 反应 3.67h， 生成 1-(1,1-dimethyl-4-hydroxy-2-butynyl)-2,2,5,5-tetramethyl-1-aza-2,5-disilacyclopentane
  参考文献：
  名称：

  [EN] N-ALKYNYL-2- (SUBSTITUTED ARYLOXY) ALKYLTHIOAMIDE DERIVATIVES AS FUNGICIDES
  [FR] DERIVES DE N-ALKYNYLE-2- (SUBSTITUE ARYLOXY) ALKYLTHIOAMIDE COMME FONGICIDES

  摘要：

  一般公式（1）中的杀菌化合物，其中Ar是公式（A）、（B1）、（B2）或（C）的组，或Ar是5-或6-连接的公式（D1）或（D2）的组；且R1、R2、R3、R4、R5、n、A1、A2、A3、A4、A5、Ka、Kb、L、M、V、W、X、Y和Z具有权利要求1中给出的定义。

  公开号：

  WO2004108663A1

文献信息

• N-alkynyl-2-(substituted phenoxy) alkylamides and their use as fungicides
  申请人：Salmon Roger

  公开号：US20060194763A1

  公开（公告）日：2006-08-31

  Fungicidal compounds of the general formula (1) wherein X, Y, Z, R 1 , R 2 , R 3 , R 4 and R 5 have the definitions given in claim 1 .

  一般式（1）的杀真菌化合物，其中X、Y、Z、R1、R2、R3、R4和R5的定义如权利要求1所述。
• Pyridyloxyalkanoic acid amide derivatives useful as fungicides
  申请人：Whittingham Guy William

  公开号：US20050065032A1

  公开（公告）日：2005-03-24

  Fungicidal compounds of the general formula (I): wherein X and Y are independently H, halo, C 1-8 alkyl, C 3-6 cycloalkyl, C 2-8 alkenyl, C 2-8 alkynyl, C 1-8 alkoxy, C 1-8 alkylthio, nitro, amino, mono- or di-(C 1-6 )alkylamino, mono- or di-(C 2-6 )alkenylamino, mono- or di-(C 2-6 )alkynylamino, formylamino, C 1-4 alkyl(formyl)amino, C 1-4 alkylcarbonylamino, C 1-4 alkyl(C 1-4 alkylcarbonyl)amino, cyano, formyl, C 1-4 alkylcarbonyl, C 1-4 alkoxycarbonyl, aminocarbonyl, mono- or di-(C 1-4 )alkylaminocarbonyl, carboxy, C 1-4 alkylcarbonyloxy, aryl(C 1-4 )alkylcarbonyloxy, C 1-4 alkylsulphinyl, C 1-4 alkylsulphonyl, C 1-4 alkylsulphonyloxy, aryl, heteroaryl, aryloxy, arylthio, heteroaryloxy or heteroarylthio wherein any of the foregoing alkyl, cycloalkyl, alkenyl, alkynyl, aryl, heteroaryl, groups or moieties are optionally substituted; R 1 is phenyl, cyano, C 1-4 alkyl, C 2-4 alkenyl or C 2-4 alkynyl in which the alkyl, alkenyl and alkynyl groups are optionally substituted on their terminal carbon atom with one, two or thre halogen atoms, with a cyano group, with a C 1-4 alkylcarbonyl group, with a C 1-4 alkoxycarbonyl group or with a hydroxy group, or R 1 is alkoxyalkyl, alkylthioalkyl, alkylsulphinylalkyl or alkylsulphonylalkyl in which the total number of carbon atoms is 2 or 3; R 2 is H, C 1-4 alkyl, C 1-4 alkoxymethyl or benzyloxymethyl in which the phenyl ring of the benzyl moiety is optionally substituted with C 1-4 alkoxy; R 3 and R 4 are independently H, C 1-3 alkyl, C 2-3 alkenyl or C 2-3 alkynyl provided that both are not H and that when both are other than H their combined total of carbon atoms does not exceed 4, or R 3 and R 4 join with the carbon atom to which they are attached to form a 3 or 4 membered carbocyclic ring optionally containing one O, S or N atom and optionally substituted with halo or C 1-4 alkyl; and R 5 is halo, C 1-4 alkyl or C 3-4 cycloalkyl in which the alkyl or cycloalkyl group is optionally substituted with halo, hydroxy, C 1-6 alkoxy, C 1-6 alkylthio, cyano, C 1-4 alkylcarbonyloxy, aminocarbonyloxy, mono- or di(C 1-4 )alkylaminocarbonyloxy, or tri(C 1-4 )alkylsilyloxy. The compounds and compositions containing them are especially useful for combating fungal infections of plants.

  通式（I）的杀真菌化合物：其中X和Y独立地为H、卤素、C1-8烷基、C3-6环烷基、C2-8烯基、C2-8炔基、C1-8烷氧基、C1-8烷基硫基、硝基、氨基、单取代或双取代（C1-6）烷基氨基、单取代或双取代（C2-6）烯基氨基、单取代或双取代（C2-6）炔基氨基、甲酰氨基、C1-4烷基（甲酰）氨基、C1-4烷基羰基氨基、C1-4烷基（C1-4烷基羰基）氨基、氰基、甲酰基、C1-4烷基羰基、C1-4烷氧基羰基、氨基羰基、单取代或双取代（C1-4）烷基氨基羰基、羧基、C1-4烷基羰氧基、芳基（C1-4）烷基羰氧基、C1-4烷基亚磺酰基、C1-4烷基磺酰基、C1-4烷基磺酰氧基、芳基、杂芳基、芳氧基、芳硫基、杂芳氧基或杂芳硫基，其中上述任何烷基、环烷基、烯基、炔基、芳基、杂芳基、基团或官能团均可选择性地被取代；R1为苯基、氰基、C1-4烷基、C2-4烯基或C2-4炔基，其中烷基、烯基和炔基基团在其末端碳原子上可选择性地用一个、两个或三个卤素原子、一个氰基、一个C1-4烷基羰基、一个C1-4烷氧基羰基或一个羟基取代，或者R1为烷氧烷基、烷硫烷基、烷亚磺酰烷基或烷磺酰烷基，其中总碳原子数为2或3；R2为H、C1-4烷基、C1-4烷氧甲基或苄氧甲基，其中苄基官能团的苯环可选择性地用C1-4烷氧基取代；R3和R4独立地为H、C1-3烷基、C2-3烯基或C2-3炔基，前提是两者不都为H，且当两者都不为H时，它们的总碳原子数不超过4，或者R3和R4与它们附着的碳原子结合形成一个3或4元环烷基，其中可选择性地含有一个O、S或N原子并可选择性地用卤素或C1-4烷基取代；R5为卤素、C1-4烷基或C3-4环烷基，其中烷基或环烷基基团可选择性地用卤素、羟基、C1-6烷氧基、C1-6烷基硫基、氰基、C1-4烷基羰氧基、氨基羰氧基、单取代或双取代（C1-4）烷基氨基羰氧基或三取代（C1-4）硅烷氧基取代。这些化合物和含有它们的组合物特别适用于防治植物真菌感染。
• Fungicides
  申请人：Crowley Jeff Patrick

  公开号：US20060217346A1

  公开（公告）日：2006-09-28

  The use as a plant fungicide of a compound of general formula (1). Also included are plant fungicidal compositions containing these compounds and some of the compounds themselves.

  使用一种通式为（1）的化合物作为植物杀菌剂。还包括含有这些化合物的植物杀菌剂组合物以及其中的一些化合物本身。
• PYRIDYLOXYALKANOIC ACID AMIDE DERIVATIVES USEFUL AS FUNGICIDES
  申请人：Whittingham Guy William

  公开号：US20070135468A1

  公开（公告）日：2007-06-14

  Fungicidal compounds of the general formula (I): wherein X and Y are independently H, halo, C 1-8 alkyl, C 3-6 cycloalkyl, C 2-8 alkenyl, C 2-8 alkynyl, C 1-8 alkoxy, C 1-8 alkylthio, nitro, amino, mono- or di-(C 1-6 )alkylamino, mono- or di-(C 2-6 )alkenylamino, mono- or di-(C 2-6 )alkynylamino, formylamino, C 1-4 alkyl(formyl)amino, C 1-4 alkylcarbonylamino, C 1-4 alkyl(C 1-4 alkylcarbonyl)amino, cyano, formyl, C 1-4 alkylcarbonyl, C 1-4 alkoxycarbonyl, aminocarbonyl, mono- or di-(C 1-4 )alkylaminocarbonyl, carboxy, C 1-4 alkylcarbonyloxy, aryl(C 1-4 )alkylcarbonyloxy, C 1-4 alkylsulphinyl, C 1-4 alkylsulphonyl, C 1-4 alkylsulphonyloxy, aryl, heteroaryl, aryloxy, arylthio, heteroaryloxy or heteroarylthio wherein any of the foregoing alkyl, cycloalkyl, alkenyl, alkynyl, aryl, heteroaryl, groups or moieties are optionally substituted; R 1 is phenyl, cyano, C 1-4 alkyl, C 2-4 alkenyl or C 2-4 alkynyl in which the alkyl, alkenyl and alkynyl groups are optionally substituted on their terminal carbon atom with one, two or three halogen atoms, with a cyano group, with a C 1-4 alkylcarbonyl group, with a C 1-4 alkoxycarbonyl group or with a hydroxy group, or R 1 is alkoxyalkyl, alkylthioalkyl, alkylsulphinylalkyl or alkylsulphonylalkyl in which the total number of carbon atoms is 2 or 3; R 2 is H, C 1-4 alkyl, C 1-4 alkoxymethyl or benzyloxymethyl in which the phenyl ring of the benzyl moiety is optionally substituted with C 1-4 alkoxy; R 3 and R 4 are independently H, C 1-3 alkyl, C 2-3 alkenyl or C 2-3 alkynyl provided that both are not H and that when both are other than H their combined total of carbon atoms does not exceed 4, or R 3 and R 4 join with the carbon atom to which they are attached to form a 3 or 4 membered carbocyclic ring optionally containing one O, S or N atom and optionally substituted with halo or C 1-4 alkyl; and R 5 is halo, C 1-4 alkyl or C 3-4 cycloalkyl in which the alkyl or cycloalkyl group is optionally substituted with halo, hydroxy, C 1-6 alkoxy, C 1-6 alkylthio, cyano, C 1-4 alkylcarbonyloxy, aminocarbonyloxy, mono- or di(C 1-4 )alkylaminocarbonyloxy, or tri(C 1-4 )alkylsilyloxy. The compounds and compositions containing them are especially useful for combating fungal infections of plants.

  通式（I）的杀真菌化合物：其中X和Y独立地为H、卤素、C1-8烷基、C3-6环烷基、C2-8烯基、C2-8炔基、C1-8烷氧基、C1-8烷硫基、硝基、氨基、单或双（C1-6）烷基氨基、单或双（C2-6）烯基氨基、单或双（C2-6）炔基氨基、甲酰氨基、C1-4烷基（甲酰）氨基、C1-4烷基羰基氨基、C1-4烷基（C1-4烷基羰基）氨基、氰基、甲酰基、C1-4烷基羰基、C1-4烷氧羰基、氨基羰基、单或双（C1-4）烷基氨基羰基、羧基、C1-4烷基羰氧基、芳基（C1-4）烷基羰氧基、C1-4烷基亚砜基、C1-4烷基磺酰基、C1-4烷基磺酰氧基、芳基、杂芳基、芳氧基、芳硫基、杂芳氧基或杂芳硫基，其中上述任何烷基、环烷基、烯基、炔基、芳基、杂芳基、基团或基团可以选择性地被取代；R1为苯基、氰基、C1-4烷基、C2-4烯基或C2-4炔基，其中烷基、烯基和炔基基团可在其末端碳原子上选择性地被一个、两个或三个卤素原子、一个氰基、一个C1-4烷基羰基、一个C1-4烷氧羰基、一个羟基、或R1为烷氧基烷基、烷基硫基烷基、烷基亚砜基烷基或烷基磺酰基烷基，其中碳原子的总数为2或3；R2为H、C1-4烷基、C1-4烷氧甲基或苄氧甲基，其中苄基基团的苯环可选择性地被C1-4烷氧基取代；R3和R4独立地为H、C1-3烷基、C2-3烯基或C2-3炔基，前提是两者都不为H，并且当两者都不为H时，它们的碳原子总数不超过4，或R3和R4与它们附着的碳原子结合形成一个3或4成员的碳环，可选择性地含有一个O、S或N原子，并可选择性地取代卤素或C1-4烷基；R5为卤素、C1-4烷基或C3-4环烷基，其中烷基或环烷基基团可选择性地被卤素、羟基、C1-6烷氧基、C1-6烷硫基、氰基、C1-4烷基羰氧基、氨基羰基氧基、单或双（C1-4）烷基氨基羰基氧基或三（C1-4）烷基硅氧基取代。这些化合物和含有它们的组合物特别适用于防治植物真菌感染。
• N-alkynyl-2-(substituted aryloxy) alkylthioamine derivatives as fungicides
  申请人：Crowley Jeff Patrick

  公开号：US20070042996A1

  公开（公告）日：2007-02-22

  Fungicidal compounds of the general formula (1), wherein Ar is a group of the formula (A), (B1), (B2) or (C), or Ar is a 5- or 6-linked group of the formula (D1) or (D2); and R 1 , R 2 , R 3 , R 4 , R 5 , n, A 1 , A 2 , A 3 , A 4 , A 5 , K a , K b , L, M, V, W, X, Y and Z have the definitions given in claim 1.

  通式（1）的杀菌化合物，其中Ar是公式（A）、（B1）、（B2）或（C）的基团，或者Ar是公式（D1）或（D2）的5-或6-连接基团；R1、R2、R3、R4、R5、n、A1、A2、A3、A4、A5、Ka、Kb、L、M、V、W、X、Y和Z的定义如权利要求1所述。