4-propylphenyl benzoate | 93434-08-3

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 缩酚酸和缩酚酸环醚类
• 英文名称: 4-propylphenyl benzoate
• 英文别名: (4-Propylphenyl) benzoate
• CAS: 93434-08-3
• 化学式: C₁₆H₁₆O₂
• 分子量: 240.302
• InChiKey: ZTOPDMKQCXHBKQ-UHFFFAOYSA-N

物化性质

• 熔点：
  37-38 °C
• 沸点：
  356.5±21.0 °C(Predicted)
• 密度：
  1.081±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  18
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  4-propylphenyl benzoate 在 二氯乙酸 、 bis(dimethylglyoximatodifluoroboryl)cobalt(II) 、 3,6‐di‐tert‐butyl‐9‐(4‐fluoro‐2,6‐dimethylphenyl)‐10‐phenylacridin‐10‐ium tetrafluoroborate 、 水 作用下， 以 乙腈 为溶剂， 反应 8.0h， 以58%的产率得到4-(2-oxopropyl)phenyl benzoate
  参考文献：
  名称：

  由双重有机光氧化还原和钴催化实现的均苄基氧化

  摘要：

  在更活化的苄基 C(sp3)-H 键存在的情况下激活脂肪族 C(sp3)-H 键通常是一项非常重要的任务，即使不是不可能的任务。在本文中，我们表明，可以使用双有机光氧化还原/钴催化，利用苄基 C(sp3)-H 键的反应性来实现高苄基位置的反应性。通过两部分催化系统，烷基芳烃进行脱氢，然后进行反马尔科夫尼科夫瓦克型氧化，生成苄基酮产品。这种正式的均苄氧化是在不使用导向基团的情况下以高原子经济性完成的；实现传统上需要多次化学转化的有价值的反应性。

  DOI：

  10.1021/jacs.0c04422
• 作为产物：
  描述：

  4-丙基苯酚 、 苯甲酰氯 在 4-二甲氨基吡啶 、 三乙胺 作用下， 反应 24.0h， 以83%的产率得到4-propylphenyl benzoate
  参考文献：
  名称：

  乙酸芳基酯的选择性镍催化加氢脱乙酰氧基化

  摘要：

  在绿色溶剂碳酸二甲酯 (DMC) 中，使用频哪醇硼烷 (HBpin) 和镍-N-杂环卡宾 (NHC) 催化体系，将衍生自（可再生）酚醛的富电子乙酸芳基酯选择性还原为相应的芳烃。该方法适用于松木衍生的乙酸4-丙基愈创木酯。

  DOI：

  10.1002/anie.202201751

文献信息

• Freudenberg et al., Chemische Berichte, 1939, vol. 72, p. 217,226
  作者：Freudenberg et al.

  DOI：——

  日期：——
• Bartoletti, Antonella; Bartolini, Simona; Germani, Raimondo, Journal of the Chemical Society. Perkin transactions II, 1994, # 4, p. 723 - 728
  作者：Bartoletti, Antonella、Bartolini, Simona、Germani, Raimondo、Savelli, Gianfranco、Bunton, Clifford A.

  DOI：——

  日期：——
• Polarizing, photochromic devices and methods of making the same
  申请人：Kumar Anil

  公开号：US20050012998A1

  公开（公告）日：2005-01-20

  Various embodiments disclosed herein relate to optical elements comprising an at least partial coating having a first state and a second state connected to at least a portion of a substrate, the at least partial coating being adapted to switch from the first state to the second state in response to at least actinic radiation, to revert back to the first state in response to thermal energy, and to linearly polarize at least transmitted radiation in at least one of the first state and the second state. Other embodiments relate to optical elements comprising a substrate and at least one at least partially aligned photochromic-dichroic compound connected to at least a portion of the substrate and having an average absorption ratio greater than 2.3 in the activated state as determined according to CELL METHOD. Still other embodiments relate to security devices, liquid crystal cells and methods of making the same.
• Polirizing, photochromic devices and methods of making the same
  申请人：Kumar Anil

  公开号：US20070053048A1

  公开（公告）日：2007-03-08

  An optical element including: a substrate; and an at least partial coating having a first state and a second state on at least a portion of the substrate, the at least partial coating being adapted to be circularly polarizing or elliptically polarizing in at least one state and containing: a chiral nematic or cholesteric liquid crystal material having molecules that are helically arranged through a thickness of the at least partial coating; and at least one photochromic-dichroic compound that is at least partially aligned with the liquid crystal material such that a long axis of a molecule of the photochromic-dichroic compound is generally parallel to the molecules of the liquid crystal material.
• PHOTOCHROMIC COMPOUNDS
  申请人：Kumar Anil

  公开号：US20080045704A1

  公开（公告）日：2008-02-21

  Various non-limiting embodiments disclosed herein relate generally to photochromic compounds, which may be thermally reversible or non-thermally reversible, and articles made therefrom. Other non-limiting embodiments relate to photochromic-dichroic compounds, which may be thermally reversible or non-thermally reversible, and articles made therefrom. For example, one non-limiting embodiment provides a thermally reversible, photochromic compound adapted to have at least a first state and a second state, wherein the thermally reversible, photochromic compound has an average absorption ratio greater than 2.3 in at least one state as determined according to CELL METHOD. Another non-limiting embodiment provides a photochromic compound comprising: (a) at least one photochromic group chosen from a pyran, an oxazine, and a fulgide; and (b) at least one lengthening agent L attached to the at least one photochromic group and represented by the formula —[S 1 ] c -[Q 1 -[S 2 ] d ] d′ -[Q 2 -[S 3 ] e ] e′ -[Q 3 -[S 4 ] f ] f′ —S 5 —P, which is described herein.