1-癸醇-D21 | 110510-78-6

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 中文名称: 1-癸醇-D21
• 英文名称: Decanol-d21
• 英文别名: N-Decyl-D21 alcohol；1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-henicosadeuteriodecan-1-ol
• CAS: 110510-78-6
• 化学式: C₁₀H₂₂O
• 分子量: 179.117
• InChiKey: MWKFXSUHUHTGQN-SLBGAMDCSA-N

物化性质

• 熔点：
  179.4 °C

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  11
• 可旋转键数：
  8
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

安全信息

• 储存条件：
  2-8°C

制备方法与用途

1-癸醇-d21是一种含有氘标记的1-癸醇[1]。

反应信息

• 作为反应物：
  描述：

  1-癸醇-D21 在 吡啶 、 sodium hydride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 89.0h， 生成 pentabromophenyl-perdeuterodecyl ether
  参考文献：
  名称：

  Chemically-Induced Discotic Liquid Crystals. Structural Studies with Nmr Spectroscopy

  摘要：

  Deuterium NMR spectroscopy provides an especially important technique with which to investigate a wide range of liquid crystal behaviour. Here, we describe its use in the structural study of liquid crystals formed from discotic or disc-like molecules and, to illustrate the breadth and power of the NMR method, we have selected two systems in which the liquid crystal phases are chemically induced. The binary mixtures are similar in that one component is a radial multiyne but differ significantly in the nature of the chemical inductor. In one case the inductor is a nitrated fluorenone which has a similar anisotropy to the radial multiyne while for the second system the inductor, a substituted o-xylene is considerably smaller and far less anisotropic. By measuring the deuterium NMR spectra of suitably deuteriated versions of the components we show how it is possible to investigate the orientational order of the components in the various induced phases, their effective molecular symmetry, the molecular geometry, the chain flexibility and orientational order together with the phase symmetry. The results of these investigations are described and explained.

  DOI：

  10.1080/15421400390213311
• 作为产物：
  描述：

  正癸酸 在 platinum on activated charcoal lithium aluminium deuteride 、 氘氧化钠 作用下， 以 四氢呋喃 、 重水 为溶剂， 反应 215.0h， 生成 1-癸醇-D21
  参考文献：
  名称：

  Chemically-Induced Discotic Liquid Crystals. Structural Studies with Nmr Spectroscopy

  摘要：

  Deuterium NMR spectroscopy provides an especially important technique with which to investigate a wide range of liquid crystal behaviour. Here, we describe its use in the structural study of liquid crystals formed from discotic or disc-like molecules and, to illustrate the breadth and power of the NMR method, we have selected two systems in which the liquid crystal phases are chemically induced. The binary mixtures are similar in that one component is a radial multiyne but differ significantly in the nature of the chemical inductor. In one case the inductor is a nitrated fluorenone which has a similar anisotropy to the radial multiyne while for the second system the inductor, a substituted o-xylene is considerably smaller and far less anisotropic. By measuring the deuterium NMR spectra of suitably deuteriated versions of the components we show how it is possible to investigate the orientational order of the components in the various induced phases, their effective molecular symmetry, the molecular geometry, the chain flexibility and orientational order together with the phase symmetry. The results of these investigations are described and explained.

  DOI：

  10.1080/15421400390213311

文献信息

• [EN] INHIBITORS OF PHOSPHOLIPID SYNTHESIS AND METHODS OF USE<br/>[FR] INHIBITEURS DE SYNTHÈSE DE PHOSPHOLIPIDES ET PROCÉDÉS D'UTILISATION
  申请人：UNIV LELAND STANFORD JUNIOR

  公开号：WO2019165232A1

  公开（公告）日：2019-08-29

  Inhibitors of Glycerol 3-Phosphate Acyltransferase (GPAT) are provided; and methods of use in the treatment of cancer; and treatment of conditions relating to metabolic syndrome and hyperlipidemia.

  提供了甘油3-磷酸酰转移酶（GPAT）的抑制剂；以及在癌症治疗中使用的方法；以及治疗与代谢综合征和高脂血症相关的疾病的方法。