5-tert-butylindane-1,3-dione | 1035696-59-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 茚满类
• 英文名称: 5-tert-butylindane-1,3-dione
• 英文别名: 5-Tert-butylindene-1,3-dione
• CAS: 1035696-59-3
• 化学式: C₁₃H₁₄O₂
• 分子量: 202.253
• InChiKey: DVENPTQJHUTLJD-UHFFFAOYSA-N

物化性质

• 沸点：
  343.2±42.0 °C(Predicted)
• 密度：
  1.134±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  34.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  4-(bis(5,5,5-triphenylpentyl)amino)benzaldehyde 、 5-tert-butylindane-1,3-dione 在 哌啶 作用下， 反应 4.0h， 以0.48 g的产率得到2-(4-(bis(5,5,5-triphenylpentyl)amino)benzylidene)-5-(tert-butyl)-1H-indene-1,3(2H)-dione
  参考文献：
  名称：

  Modular approach to obtaining organic glasses from low-molecular weight dyes using 1,1,1-triphenylpentane auxiliary groups: Nonlinear optical properties

  摘要：

  A new modular synthetic approach to obtain organic glasses from low-molecular weight azobenzenes and stilbenes has been accomplished using 1,1,1-triphenylpentane crystallization preventing auxiliary groups. Six new structures show excellent solubility in non-polar solvents and thin films with good optical qualities have been obtained using a spin-coating technique. The glass transition temperatures of the new amorphous materials were in the range of 73-108 degrees C. The nonlinear optical activity in thin amorphous films was measured after a corona poling procedure. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.dyepig.2013.08.020
• 作为产物：
  描述：

  4-叔丁基邻苯二甲酸 在 sodium 作用下， 以 甲醇 、 乙醇 、 甲基叔丁基醚 、 水 、 乙酸乙酯 为溶剂， 反应 8.0h， 生成 5-tert-butylindane-1,3-dione
  参考文献：
  名称：

  Modular approach to obtaining organic glasses from low-molecular weight dyes using 1,1,1-triphenylpentane auxiliary groups: Nonlinear optical properties

  摘要：

  A new modular synthetic approach to obtain organic glasses from low-molecular weight azobenzenes and stilbenes has been accomplished using 1,1,1-triphenylpentane crystallization preventing auxiliary groups. Six new structures show excellent solubility in non-polar solvents and thin films with good optical qualities have been obtained using a spin-coating technique. The glass transition temperatures of the new amorphous materials were in the range of 73-108 degrees C. The nonlinear optical activity in thin amorphous films was measured after a corona poling procedure. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.dyepig.2013.08.020

文献信息

• PYRIDOPYRIMIDINONE INHIBITORS OF KINASES
  申请人：AbbVie Inc.

  公开号：US20130225589A1

  公开（公告）日：2013-08-29

  The present invention relates to compounds of formula (I) or pharmaceutical acceptable salts, wherein R 1 , R 2 , R 3 , R 4 , and B are defined in the description. The present invention relates also to compositions containing said compounds which are useful for inhibiting kinases such as wee-1 and methods of treating diseases such as cancer.

  本发明涉及式(I)化合物或药理可接受的盐，其中R1、R2、R3、R4和B在描述中定义。本发明还涉及包含所述化合物的组合物，这些化合物可用于抑制诸如wee-1的激酶，以及治疗诸如癌症疾病的方法。
• ORGANIC COMPOUND, AND PHOTOELECTRIC CONVERSION ELEMENT AND IMAGING DEVICE USING THE ORGANIC COMPOUND
  申请人：CANON KABUSHIKI KAISHA

  公开号：US20190115545A1

  公开（公告）日：2019-04-18

  An organic compound represented by the following formula [1] has a high absorption coefficient in a long wavelength region and is thermally stable. In formula [1], Ar 1 and Ar 2 each represent a group independently selected from the group consisting of aryl group and heterocyclic groups, and A represents a cyclic structure. m represents an integer of 0 to 2. Q represents a structure represented by one of the following formulas [1-1] and [1-2], wherein n represents an integer of 0 to 2, and when n is 2, the two R 4 's may be the same as or different from each other, and the two R 5 's may be the same as or different from each other.

  由以下公式[1]表示的有机化合物在长波长区域具有很高的吸收系数，并且具有热稳定性。在公式[1]中，Ar1和Ar2分别代表从芳基团和杂环基团中独立选择的基团，并且A代表一个环状结构。m表示0到2之间的整数。Q表示以下公式[1-1]和[1-2]中的一个所表示的结构，其中n表示0到2之间的整数，当n为2时，两个R4可能相同也可能不同，两个R5可能相同也可能不同。
• CHROMAN DERIVATIVES AS TRPM8 INHIBITORS
  申请人：AMGEN INC.

  公开号：US20140045855A1

  公开（公告）日：2014-02-13

  Chroman compounds and derivatives of Formula I are useful inhibitors of TRPM8. Such compounds are useful in treating a number of TRPM8 mediated disorders and conditions and may be used to prepare medicaments and pharmaceutical compositions useful for treating such disorders and conditions. Examples of such disorders include, but are not limited to, migraines and neuropathic pain. Compounds of Formula I have the following structure: where the definitions of the variables are provided herein.

  Formula I的Chroman化合物和衍生物是TRPM8的有用抑制剂。这些化合物在治疗多种由TRPM8介导的疾病和症状方面具有用途，并可用于制备治疗这些疾病和症状的药物和药物组合物。这些疾病的例子包括，但不限于，偏头痛和神经病性疼痛。Formula I的化合物具有以下结构：变量的定义在此提供。
• TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS
  申请人：Biswas Kaustav

  公开号：US20130157996A1

  公开（公告）日：2013-06-20

  Compounds of Formula I are useful as antagonists of TRPM8. Such compounds are useful in treating a number of TRPM8 mediated disorders and conditions and may be used to prepare medicaments and pharmaceutical compositions useful for treating such disorders and conditions. Examples of such disorders include, but are not limited to, migraines and neuropathic pain. Compounds of Formula I have the following structure: where the definitions of the variables are provided herein.

  公式I的化合物可用作TRPM8的拮抗剂。这些化合物在治疗许多TRPM8介导的疾病和病症方面非常有用，并可用于制备用于治疗此类疾病和病症的药物和制剂。此类疾病的示例包括但不限于偏头痛和神经病性疼痛。公式I的化合物具有以下结构：其中变量的定义在此提供。
• Dye and recording media utilizing the same
  申请人：Wang Shin-Shin

  公开号：US20080160244A1

  公开（公告）日：2008-07-03

  The invention provides dyes for optical disc recoding media, having the general formula: wherein m, n is independently selected from integers 0-3; X represents oxygen, sulfur, C—R 1 , or N—R 2 R 3 ; Y is oxygen or sulfur; each of R 1 , R 2 , and R 3 can be the same or different; and Z ⊕ is a cation. The dyes have a maximum absorption in wavelength of 300-500 nm and can be used in recording layers of high density optical disc recording media.