2,6,6-trimethylheptan-3-one | 40238-56-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2,6,6-trimethylheptan-3-one
• CAS: 40238-56-0
• 化学式: C₁₀H₂₀O
• 分子量: 156.268
• InChiKey: AEKITXOGZSNKNJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  11
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.9
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  2,6,6-trimethylheptan-3-one 在 溴 作用下， 以 四氯化碳 为溶剂， 生成 2,4-dibromo-2,6,6-trimethyl-heptan-3-one
  参考文献：
  名称：

  Regioselectivity in the reductive acyloxylation of .alpha.,.alpha.'-dibromo ketones

  摘要：

  DOI：

  10.1021/jo01322a018

文献信息

• ISOXAZOLINE DERIVATIVES AS INSECTICIDES
  申请人：Pitterna Thomas

  公开号：US20120316124A1

  公开（公告）日：2012-12-13

  The present invention relates to compounds formula (I), wherein P is P1, P2, heterocyclyl or heterocyclyl substituted by one to five Z; and wherein A 1 , A 2 , A 3 , A 4 , G 1 , R 1 , R 2 , R 3 , R 4 , R 5 , R 6 , R 17 , R 18 , R 19 and R 20 are as defined in claim 1 ; or a salt or N-oxide thereof. Furthermore, the present invention relates to processes and intermediates for preparing compounds of formula (I), to insecticidal, acaricidal, nematicidal and molluscicidal compositions comprising the compounds of formula (I) and to methods of using the compounds of formula (I) to control insect, acarine, nematode and mollusc pests.

  本发明涉及化合物式（I），其中P为P1、P2、杂环烷基或被1至5个Z取代的杂环烷基；以及其中A1、A2、A3、A4、G1、R1、R2、R3、R4、R5、R6、R17、R18、R19和R20如权利要求1所定义；或其盐或N-氧化物。此外，本发明涉及制备化合物式（I）的过程和中间体，包括化合物式（I）的杀虫剂、杀螨剂、杀线虫剂和杀软体动物剂组合物，以及使用化合物式（I）控制昆虫、螨虫、线虫和软体动物害虫的方法。
• Hepatitis C Virus Inhibitors
  申请人：Bristol-Myers Squibb Company

  公开号：US20130183269A1

  公开（公告）日：2013-07-18

  The present disclosure is generally directed to antiviral compounds, and more specifically directed to combinations of compounds which can inhibit the function of the NS5A protein encoded by Hepatitis C virus (HCV), compositions comprising such combinations, and methods for inhibiting the function of the NS5A protein.

  本公开涉及抗病毒化合物，更具体地涉及能够抑制丙型肝炎病毒（HCV）编码的NS5A蛋白功能的化合物组合，包括这种组合的组成物，以及抑制NS5A蛋白功能的方法。
• PROCESS FOR THE PREPARATION OF DIHYDROPYRROLE DERIVATIVES
  申请人：El Qacemi Myriem

  公开号：US20130237583A1

  公开（公告）日：2013-09-12

  The present invention provides stereoselective processes for the preparation of compounds of formula (I) wherein P is phenyl, naphthyl, a 6-membered heteroaryl group containing one or two nitrogen atoms as ring members, or a 10-membered bicyclic heteroaryl group containing one or two nitrogen atoms as ring members, and wherein the phenyl, naphthyl and heteroaryl groups are optionally substituted; R 1 is chlorodifluoromethyl or trifluoromethyl; R 2 is optionally substituted aryl or optionally substituted heteroaryl; n is 0 or 1; including the process comprising (a-i) reacting a compound of formula II wherein P, R 1 and R 2 are as defined for the compound of formula I; with nitromethane in the presence a chiral catalyst to give a compound of formula III Wherein P, R 1 and R 2 are as defined for the compound of formula I; and (a-ii) reductively cyclising the compound of formula III to give the compound of formula I. The invention also provides intermediates useful for processes for the synthesis of compounds of formula (I).

  本发明提供了立体选择性的方法，用于制备式（I）化合物，其中P是苯基、萘基、含有一个或两个氮原子作为环成员的6元杂环芳基基团或含有一个或两个氮原子作为环成员的10元双环杂环芳基基团，苯基、萘基和杂环芳基基团是可选择性取代的；R1是氯二氟甲基或三氟甲基；R2是可选择性取代的芳基或可选择性取代的杂环芳基；n为0或1；包括以下过程：（a-i）将式II化合物与硝甲烷在手性催化剂存在下反应，其中P、R1和R2与式I化合物定义相同，得到式III化合物，其中P、R1和R2与式I化合物定义相同；（a-ii）还原环化式III化合物，得到式I化合物。本发明还提供了用于合成式（I）化合物的中间体。
• DIHYDROFURAN DERIVATIVES AS INSECTICIDAL COMPOUNDS
  申请人：Smejkai Tomas

  公开号：US20140235533A1

  公开（公告）日：2014-08-21

  The present invention provides compounds of formula I wherein Q is Q1 or Q2; A 1 , A 2 , A 3 and A 4 are independently of each other C—H, C—R 7 , or nitrogen; R 1 is C 1 -C 8 haloalkyl; R 2 is aryl or aryl substituted by one to five R 11 , or heteroaryl or heteroaryl substituted by one to five R 11 ; and R 3 , R 4 , R 5 , R 6 and R 7 are as defined in the claims. The invention also provides methods of controlling insects, acarines, nematodes or molluscs which methods comprise applying to a pest, to a locus of a pest, or to a plant susceptible to attack by a pest an insecticidally, acaricidally, nematicidally or molluscicidally effective amount of a compound of formula (I).

  本发明提供了式I的化合物，其中Q是Q1或Q2；A1、A2、A3和A4独立地是C-H、C-R7或氮；R1是C1-C8卤代烷基；R2是芳基或芳基上被1-5个R11取代，或杂环芳基或杂环芳基上被1-5个R11取代；R3、R4、R5、R6和R7如权利要求中所定义。本发明还提供了控制昆虫、螨、线虫或软体动物的方法，该方法包括向害虫、害虫的生境或易受害虫攻击的植物施用式（I）的杀虫、杀螨、杀线虫或杀软体动物有效量的化合物。
• HEPATITIS C VIRUS INHIBITORS
  申请人：BRISTOL-MAYERS SQUIBB COMPANY

  公开号：US20160199355A1

  公开（公告）日：2016-07-14

  The present disclosure is generally directed to antiviral compounds, and more specifically directed to combinations of compounds which can inhibit the function of the NS5A protein encoded by Hepatitis C virus (HCV), compositions comprising such combinations, and methods for inhibiting the function of the NS5A protein.

  本公开涉及抗病毒化合物，更具体地涉及能够抑制丙型肝炎病毒（HCV）编码的NS5A蛋白功能的化合物组合、包含这种组合的组合物，以及抑制NS5A蛋白功能的方法。