1,3,5-tributyrylperhydro-1,3,5-triazine | 40534-87-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 三嗪烷类
• 英文名称: 1,3,5-tributyrylperhydro-1,3,5-triazine
• 英文别名: 1,3,5-tributyryl-[1,3,5]triazinane；1,3,5-Tri-n-butyryl-hexahydro-s-triazin；1-[3,5-Di(butanoyl)-1,3,5-triazinan-1-yl]butan-1-one
• CAS: 40534-87-0
• 化学式: C₁₅H₂₇N₃O₃
• 分子量: 297.398
• InChiKey: JNSZVSMFSFWSDR-UHFFFAOYSA-N

物化性质

• 熔点：
  94 °C
• 沸点：
  524.0±45.0 °C(Predicted)
• 密度：
  1.091±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  21
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  60.9
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  丁腈 以90%的产率得到
  参考文献：
  名称：

  LADHAR F.; GHARBI R. ET.; DELMAS M.; GASET A., SYNTHESIS,(1986) N 8, 643-644

  摘要：

  DOI：

文献信息

• [EN] COMPOUNDS FOR TREATING CANCER<br/>[FR] COMPOSÉS PERMETTANT DE TRAITER LE CANCER
  申请人：BICYCLERD LTD

  公开号：WO2018127699A1

  公开（公告）日：2018-07-12

  The present invention provides compounds, compositions thereof, and methods of using the same.

  本发明提供了化合物、其组合物以及使用方法。
• Synthesis of 1,3,5-Triacylperhydro-1,3,5-triazines Catalyzed by Ion-Exchange Resins
  作者：F. Ladhar、R. El Gharbi、M. Delmas、A. Gaset

  DOI：10.1055/s-1986-31730

  日期：——

  1,3,5-Triacylperhydro-1,3,5-triazines can be obtained in high yields by reaction of 1,3,5-trioxan with nitriles in solvents such as chlorobenzene using as catalyst an ion-exchange resin such as Amberlyst 15® with precise control of the hydration rate of the resin.

  高产量的1,3,5-三酰基过氢-1,3,5-三嗪可以通过在氯苯等溶剂中将1,3,5-三氧杂烷与腈类反应来获得，催化剂为离子交换树脂，如Amberlyst 15®，并对树脂的水合速率进行精确控制。
• Triacylperhydro-1,3,5-triazines over Phenylsulfonic Acid Functionalized Mesoporous Silica
  作者：Jianming Yang、Qinwei Yu、Fengwei Zhao、Jian Lu、Zhongxue Ge

  DOI：10.1080/00397911.2010.517887

  日期：2011.12.1

  An operationally simple, efficient, and environmentally benign synthesis of 1,3,5-triacylperhydro-1,3,5-triazines in good yields by reaction of different organic nitriles and trioxane in the presence of phenylsulfonic acid functionalized mesoporous silica under mild conditions was examined. The yields of the corresponding 1,3,5-trisubstituted perhydro-s-triazines synthesized from acetonitrile, propionitrile, butyronitrile, benzonitrile, and 1.3.5-trioxane were 95.7%, 96.1%, 84.2%, and 98.1%, respectively. The products were characterized by H-1 NMR, infrared, mass spectrometry, and elemental analysis. The mechanism of the formation of 1,3,5-triacylperhydro-1,3,5-triazines in acidic conditions was also described using a model reaction of butyronitrile with trioxane.
• COMPOSITIONS AND METHODS FOR ALTERING THE APPEARANCE OF HAIR
  申请人：L'OREAL

  公开号：US20140305464A1

  公开（公告）日：2014-10-16

  Disclosed are methods and compositions for altering the color of hair, comprising treating the hair with a pre-alkalizing composition and then treating the hair with a color-altering composition comprising at least one lift-enhancing agent, at least one oxidative dye precursor, at least one oxidizing agent chosen from peroxides, persulfates, perborates, percarbonates, peracids, bromates, their salts and mixtures thereof, and optionally, at least one direct dye.
• METHODS FOR ALTERING THE COLOR AND APPEARANCE OF HAIR
  申请人：DEGEORGE Michael

  公开号：US20150265513A1

  公开（公告）日：2015-09-24

  Disclosed are methods and compositions for altering the color of hair, comprising treating the hair with a pre-alkalizing composition and then treating the hair with a color-altering composition comprising at least one direct dye and optionally at least one oxidative dye precursor.