1-phenyl-3-propylhexan-1-one

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-phenyl-3-propylhexan-1-one
• 英文别名: 4-Heptylacetophenone
• 化学式: C₁₅H₂₂O
• 分子量: 218.339
• InChiKey: ZRIUTZDELICFDR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  16
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  4-庚醇 、 苯乙酮 在 Ru-MACHO 、 potassium tert-butylate 作用下， 以 甲苯 为溶剂， 反应 24.0h， 以35%的产率得到1-phenyl-3-propylhexan-1-one
  参考文献：
  名称：

  仲醇用钌催化酮的α-烷基化反应生成β-二取代酮

  摘要：

  各种各样的芳香族酮已成功地用各种未活化的仲醇作为烷基化剂进行了功能化，从而以良好的产率提供了β-二取代的酮类产品。值得注意的是，在这种钌催化下，具有挑战性的底物（例如简单的苯乙酮衍生物）可以有效地烷基化。取代的环己醇化合物显示出产物诱导的非对映选择性。机理研究表明，氢借入途径参与了这些烷基化反应。值得注意的是，这种选择性的催化C–C键形成反应仅需极少量的催化剂和碱，即可产生H 2 O作为唯一的副产物，因此该方案具有吸引力且对环境无害。

  DOI：

  10.1021/acs.orglett.0c02787

文献信息

• 2-FLUORO-1,3-BENZODITHIOL 1,1,3,3-TETRAOXIDE DERIVATIVE, PRODUCTION METHOD THEREOF, AND PRODUCTION METHOD OF MONOFLUOROMETHYL GROUP-CONTAINING COMPOUND USING THE SAME
  申请人：Shibata Norio

  公开号：US20110319637A1

  公开（公告）日：2011-12-29

  A 2-fluoro-1,3-benzodithiol 1,1,3,3-tetraoxide derivative as a monofluoromethyl group introduction agent that is effective as an intermediate in pharmaceutical and agrochemical synthesis, a production method thereof, and a production method of a monofluoromethyl group-containing compound using this 2-fluoro-1,3-benzodithiol 1,1,3,3-tetraoxide derivative are provided. The 2-fluoro-1,3-benzodithiol 1,1,3,3-tetraoxide derivative represented by the following general formula (1) (wherein R 1 , R 2 , R 3 , and R 4 each independently represent a hydrogen atom, a straight-chain or branched alkyl group having 1 to 4 carbon atoms, a straight-chain or branched alkyloxy group having 1 to 4 carbon atoms, a halogen atom, a nitro group, or a cyano group), the production method thereof, and various monofluoromethyl group-containing compounds are manufactured using this 2-fluoro-1,3-benzodithiol 1,1,3,3-tetraoxide derivative as a monofluoromethylating agent.

  一种2-氟-1,3-苯二硫醚-1,1,3,3-四氧化物衍生物作为单氟甲基基团引入剂，可作为制药和农药合成中间体，提供其生产方法，以及使用该2-氟-1,3-苯二硫醚-1,1,3,3-四氧化物衍生物制备含单氟甲基基团的化合物的生产方法。所述2-氟-1,3-苯二硫醚-1,1,3,3-四氧化物衍生物由下述通用式（1）表示（其中R1、R2、R3和R4各自独立地表示氢原子、具有1至4个碳原子的直链或支链烷基基团、具有1至4个碳原子的直链或支链烷氧基基团、卤素原子、硝基团或氰基团），提供其生产方法，并使用该2-氟-1,3-苯二硫醚-1,1,3,3-四氧化物衍生物作为单氟甲基化剂制造各种含单氟甲基基团的化合物。
• Thermochromic microencapsulated pigments
  申请人：THE PILOT INK CO., LTD.

  公开号：EP1084860A2

  公开（公告）日：2001-03-21

  Disclosed is a thermochromic microencapsulated pigment which comprises as four essential components (a) an electron-donating chromatic organic compound, (b) an electron-accepting compound, (c) a reaction medium determining the temperatures at which the color reactions of component (a) with component (b) take place, and (d) a color change temperature regulator, the color change temperature regulator (d) comprising one or more compounds selected from the group consisting of esters, alcohols, ketones, acid amides, hydrocarbons, and fatty acids and having a melting point Y (°C) satisfying the relationship (X+30)°C≤Y≤200°C, wherein X (°C) is the melting point of component (c), and the four essential components being microencapsulated.

  本发明公开了一种热致变色微胶囊颜料，它由四种基本成分组成：(a) 一种电子供色有机化合物；(b) 一种电子受色化合物；(c) 一种决定成分(a)与成分(b)发生颜色反应的温度的反应介质；(d) 一种变色温度调节剂、变色温度调节剂(d)包括一种或多种从酯、醇、酮、酸酰胺、烃和脂肪酸组成的组中选出的化合物，其熔点 Y(℃)满足(X+30)℃≤Y≤200℃的关系，其中 X(℃)是组分(c)的熔点，四种基本组分被微胶囊化。
• WRITING IMPLEMENT AND WRITING IMPLEMENT SET
  申请人：THE PILOT INK CO., LTD.

  公开号：EP2072277A1

  公开（公告）日：2009-06-24

  Provided are a writing instrument produced at a lower cost than conventional thermochromic writing instruments utilizing frictional heat, slim like a pencil and not bulky because it contains an ink directly in a barrel thereof, and excellent in portability; and a set of the writing instruments. The writing instrument 1 is obtained by directly filling a barrel thereof with an ink 2 which becomes colorless or colored, or undergoes a color change by heating and an ink follower 5 following the ink with its consumption; firmly fixing a writing tip portion 3 to the end of the barrel directly or via a relay member; and disposing a friction body 6 having an elasticity at the rear end portion of the barrel. The writing instrument set has a plurality of the writing instruments respectively different from each other in color tone.

  本发明提供了一种书写工具，与传统的利用摩擦热的热致变色书写工具相比，其生产成本更低；该书写工具像铅笔一样纤细，由于直接在其笔管中装有墨水而不笨重，并且便携性极佳；还提供了一套该书写工具。 书写工具 1 是通过以下方式获得的：在其笔管中直接注入墨水 2，墨水 2 通过加热变为无色或有色，或发生颜色变化，墨水跟随器 5 随着墨水的消耗而变化；将书写尖端部分 3 直接或通过中继部件牢固地固定在笔管的末端；以及在笔管的后端部分配置具有弹性的摩擦体 6。这套书写工具具有多个色调各不相同的书写工具。
• REVERSIBLY THERMOCHROMIC COMPOSITION
  申请人：Kabushiki Kaisha Pilot Corporation

  公开号：EP2772523A1

  公开（公告）日：2014-09-03

  [Object] To provide a reversibly thermochromic composition free from accidental discoloration by heat conducting from the opposite side writing surface or by self-heating due to quick writing; and also to provide a solid writing material and a writing ink composition comprising that composition. [Means to solve the problem] A reversibly thermochromic composition comprising a combination of: (a) a reversibly thermochromic component capable of being discolored or decolored by heat and (b) a component for controlling heat conducting to the reversibly thermochromic component; and also a solid writing material and a writing ink composition comprising that composition.

  [目的]提供一种可逆热致变色组合物，该组合物不会因反面书写面的热传导或快速书写导致的自热而意外变色；还提供一种固体书写材料和包含该组合物的书写墨水组合物。 [解决问题的方法] 一种可逆热致变色组合物，由以下物质组合而成：(a) 能够受热变色或脱色的可逆热致变色成分和 (b) 用于控制热量传导至可逆热致变色成分的成分；以及包含该成分的固体书写材料和书写墨水组合物。
• SOLID WRITING MATERIAL
  申请人：Kabushiki Kaisha Pilot Corporation

  公开号：EP2957608A1

  公开（公告）日：2015-12-23

  The invention aims at providing a solid writing material having a good color changing property or color extinguishing property, and having an excellent light resistance, moldability and strength. The solid writing material includes an inner core usable for writing and an outer shell covering an outer peripheral surface of the inner core; the inner core including a reversible thermochromic microcapsuled pigment encapsulating a temperature-sensitive color-changeable color-memorizing composition and an excpient; the temperature-sensitive color-changeable color-memorizing composition including at least (a) an electron-donating coloring organic compound, (b) an electron accepting compound and (c) a reaction medium effecting reversibly an electron transfer reaction between the (a) and (b) components in a specific temperature range; the outer shell including a filler.

  本发明旨在提供一种固体书写材料，该材料具有良好的变色性能或褪色性能，并具有优异的耐光性、成型性和强度。该固体书写材料包括一个可用于书写的内芯和一个覆盖内芯外周表面的外壳；内芯包括一个可逆热致变色微胶囊颜料，其中封装了一种对温度敏感的可变色记色组合物和一种赋形剂；感温变色记色组合物至少包括(a)一种电子捐赠着色有机化合物，(b)一种电子接受化合物和(c)一种反应介质，在特定温度范围内可逆地影响(a)和(b)组分之间的电子转移反应；外壳包括填料。