5-(4-bromophenyl)pentan-1-ol | 167987-68-0

• 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: 5-(4-bromophenyl)pentan-1-ol
• 英文别名: 5-(p-Bromphenyl)-pentanol
• CAS: 167987-68-0
• 化学式: C₁₁H₁₅BrO
• 分子量: 243.143
• InChiKey: DWRYJWSNAKXJHM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  13
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  5-(4-bromophenyl)pentan-1-ol 在 chromium(VI) oxide 、 硫酸 作用下， 以 丙酮 为溶剂， 生成 5-(4-溴苯基)戊酸
  参考文献：
  名称：

  与有机硼烷合成。十三。ω-（4-溴苯基）链烷酸的合成及其硼化

  摘要：

  通过氢硼化-热异构化-氧化，从1-溴-4-烯基苯5c - e获得ω-（4-溴苯基）链烷酸2c - e。通过与4,4,5,5,4'，4'，5'，5'-八甲基[2.2'] bi的交叉偶联反应，将它们的酯11c - e转化为相应的硼酸酯12c - e的高收率。离子液体[bmim] [BF 4 ]中的[[1,3,2]二恶硼硼烷基]（10）。使用频哪醇硼烷在离子液体中进行偶联反应可得到脱溴产物，并降低了12c - e的收率。3-（4-溴苯基）丙酸乙酯（通过与[2,2']双[[1,3,2]二氧杂硼烷基]交叉偶联，将7c）转化成3-（4- [1,3,2]二恶硼硼烷基）丙酸乙酯（9c）。

  DOI：

  10.1016/s0022-328x(02)01383-9
• 作为产物：
  描述：

  1-(4-溴苯基)戊-1-醇 在 sodium hydrogen sulfate 、 dimethyl sulfide borane 、 对叔丁基邻苯二酚 、 对苯二酚 作用下， 以 乙醚 、 二乙二醇二甲醚 为溶剂， 反应 3.0h， 生成 5-(4-bromophenyl)pentan-1-ol
  参考文献：
  名称：

  与有机硼烷合成。十三。ω-（4-溴苯基）链烷酸的合成及其硼化

  摘要：

  通过氢硼化-热异构化-氧化，从1-溴-4-烯基苯5c - e获得ω-（4-溴苯基）链烷酸2c - e。通过与4,4,5,5,4'，4'，5'，5'-八甲基[2.2'] bi的交叉偶联反应，将它们的酯11c - e转化为相应的硼酸酯12c - e的高收率。离子液体[bmim] [BF 4 ]中的[[1,3,2]二恶硼硼烷基]（10）。使用频哪醇硼烷在离子液体中进行偶联反应可得到脱溴产物，并降低了12c - e的收率。3-（4-溴苯基）丙酸乙酯（通过与[2,2']双[[1,3,2]二氧杂硼烷基]交叉偶联，将7c）转化成3-（4- [1,3,2]二恶硼硼烷基）丙酸乙酯（9c）。

  DOI：

  10.1016/s0022-328x(02)01383-9

文献信息

• [EN] TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES<br/>[FR] COMPOSÉS DE TÉTRAZOLINONE ET LEUR UTILISATION EN TANT QUE PESTICIDES
  申请人：SUMITOMO CHEMICAL CO

  公开号：WO2013162072A1

  公开（公告）日：2013-10-31

  The present invention provides a compound having an excellent efficacy for controlling pests. A tetrazolinone compound of a formula (1): [wherein R1 represents an C6-C16 aryl group, an C1-C12 alkyl group, or a C3-C12 cycloalkyl group, etc., which each optionally be substituted; R2, R3, R4 and R5 represent independently of each other a hydrogen atom, a halogen atom or an C1-C3 alkyl group, etc.; R6 represents an C1-C6 alkyl group, a C3-C6 cycloalkyl group, a halogen atom, a C1-C6 haloalkyl group, an C2-C6 alkenyl group, an C1-C6 alkoxy group, or a C1-C6 haloalkoxy group, etc.; R7, R8 and R9 represent independently of each other a hydrogen atom, a halogen atom, or an C1-C4 alkyl group, etc.; X represents an oxygen atom or a sulfur atom; and R10 represents an C1-C6 alkyl group, etc.] shows an excellent controlling efficacy on pests.

  本发明提供了一种具有优异杀虫效果的化合物。公式（1）的四唑酮化合物：[其中R1代表C6-C16芳基、C1-C12烷基或C3-C12环烷基等，每个都可以选择性地被取代；R2、R3、R4和R5分别独立地代表氢原子、卤素原子或C1-C3烷基等；R6代表C1-C6烷基、C3-C6环烷基、卤素原子、C1-C6卤代烷基、C2-C6烯基、C1-C6烷氧基或C1-C6卤代烷氧基等；R7、R8和R9分别独立地代表氢原子、卤素原子或C1-C4烷基等；X代表氧原子或硫原子；R10代表C1-C6烷基等]在杀虫方面表现出优异的控制效果。
• TETRAZOLINONE COMPOUNDS AND ITS USE
  申请人：SUMITOMO CHEMICAL COMPANY, LIMITED

  公开号：US20150031733A1

  公开（公告）日：2015-01-29

  The present invention provides a compound having an excellent efficacy for controlling pests. A tetrazolinone compound of a formula (1): [wherein, R1 represents an C6-C16 aryl group, an C1-C12 alkyl group, a C3-C12 cycloalkyl group or an adamantyl group, etc., which each optionally be substituted; R2 represents a hydrogen atom, an C1-C12 alkyl group, or a halogen atom, etc.; R4 and R5 represent independently of each other a hydrogen atom or an C1-C3 alkyl group, etc.; R6, R7, R8 and R9 represent independently of each other a hydrogen atom, a halogen atom, an C1-C12 alkyl group, a C1-C12 haloalkyl group, an C2-C12 alkenyl group, a C3-C12 cycloalkyl group, an C1-C12 alkoxy group or a C1-C12 haloalkoxy group, etc.; X and Y represent independently of each other a sulfur atom or an oxygen atom; Q represents an oxygen atom or a sulfur atom; and R10 represents an C1-C6 alkyl group, etc.] shows an excellent controlling efficacy on pests.

  本发明提供了一种具有优异的杀虫功效的化合物。公式（1）的四唑酮化合物：[其中，R1代表C6-C16芳基，C1-C12烷基，C3-C12环烷基或金刚烷基等，每个都可以选择性地被取代；R2代表氢原子，C1-C12烷基或卤素原子等；R4和R5分别独立地代表氢原子或C1-C3烷基等；R6、R7、R8和R9分别独立地代表氢原子、卤素原子、C1-C12烷基、C1-C12卤代烷基、C2-C12烯基、C3-C12环烷基、C1-C12烷氧基或C1-C12卤代烷氧基等；X和Y分别独立地代表硫原子或氧原子；Q代表氧原子或硫原子；R10代表C1-C6烷基等]在控制害虫方面表现出优异的效果。
• TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES
  申请人：SUMITOMO CHEMICAL COMPANY, LIMITED

  公开号：US20150051171A1

  公开（公告）日：2015-02-19

  The present invention provides a compound having an excellent efficacy for controlling pests. A tetrazolinone compound of a formula (1): [wherein R1 represents an C6-C16 aryl group, an C1-C12 alkyl group, or a C3-C12 cycloalkyl group, etc., which each optionally be substituted; R2, R3, R4 and R5 represent independently of each other a hydrogen atom, a halogen atom or an C1-C3 alkyl group, etc.; R6 represents an C1-C6 alkyl group, a C3-C6 cycloalkyl group, a halogen atom, a C1-C6 haloalkyl group, an C2-C6 alkenyl group, an C1-C6 alkoxy group, or a C1-C6 haloalkoxy group, etc.; R7, R8 and R9 represent independently of each other a hydrogen atom, a halogen atom, or an C1-C4 alkyl group, etc.; X represents an oxygen atom or a sulfur atom; and R10 represents an C1-C6 alkyl group, etc.] shows an excellent controlling efficacy on pests.

  本发明提供了一种具有优异的杀虫功效的化合物。公式（1）的四唑烷酮化合物：[其中，R1代表C6-C16芳基，C1-C12烷基或C3-C12环烷基等，每个都可以选择性地被取代；R2、R3、R4和R5分别独立地表示氢原子、卤素原子或C1-C3烷基等；R6表示C1-C6烷基，C3-C6环烷基，卤素原子，C1-C6卤代烷基，C2-C6烯基，C1-C6烷氧基或C1-C6卤代烷氧基等；R7、R8和R9独立地表示氢原子、卤素原子或C1-C4烷基等；X表示氧原子或硫原子；R10表示C1-C6烷基等]对害虫具有优异的控制功效。
• Antituberculous composition comprising oxazole compounds
  申请人：OTSUKA PHARMACEUTICAL CO., LTD.

  公开号：EP2269694A2

  公开（公告）日：2011-01-05

  The present invention provides antituberculous therapeutic drugs with a higher potency. The present invention provides also antituberculous therapeutic drugs containing oxazole compounds represented by (I) general formula (1): [wherein R1 represents a hydrogen atom or C1-6 alkyl group, n represents an integer of 0-6, and R2 represents general formula (A) or the like, wherein R represents a phenoxy group (at least one group selected from the group consisting of a halogen atom, an optionally halogen-substituted C1-6 alkyl group and an optionally halogen-substituted C1-6 alkoxy group may be substituted on the phenyl ring) or the like], optically active forms thereof or salts thereof, and drugs (II) such as secondary antituberculous drugs.

  本发明提供了效力更高的抗结核治疗药物。本发明还提供了含有由(I)通式(1)代表的噁唑化合物的抗结核治疗药物：[其中R1代表氢原子或C1-6烷基，n代表0-6的整数，R2代表通式(A)或类似物，其中R代表苯氧基（至少一个选自卤素原子、任选卤素取代的C1-6烷基和任选卤素取代的C1-6烷氧基组成的组中的基团可在苯基环上被取代）或类似物]，其光学活性形式或其盐，以及药物(II)如二级抗结核药物。
• Support Curvature and Conformational Freedom Control Chemical Reactivity of Immobilized Species
  作者：Tino Zdobinsky、Pradipta Sankar Maiti、Rafal Klajn

  DOI：10.1021/ja411573a

  日期：2014.2.19

  We show that bimolecular reactions between species confined to the surfaces of nanoparticles can be manipulated by the nature of the linker, as well as by the curvature of the underlying particles.