4'-Octyloxy-biphenyl-4-carboxylic acid 4-formyl-phenyl ester | 62724-66-7

• 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'-Octyloxy-biphenyl-4-carboxylic acid 4-formyl-phenyl ester
• 英文别名: (4-formylphenyl) 4-(4-octoxyphenyl)benzoate
• CAS: 62724-66-7
• 化学式: C₂₈H₃₀O₄
• 分子量: 430.544
• InChiKey: BROBHUFCCXZVDY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.12
• 重原子数：
  32.0
• 可旋转键数：
  12.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  52.6
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  4'-Octyloxy-biphenyl-4-carboxylic acid 4-formyl-phenyl ester 、 丙酮 在 L-脯氨酸 作用下， 以18%的产率得到4-(1-hydroxy-3-oxobutyl)phenyl 4'-(octyloxy)biphenyl-4-carboxylate
  参考文献：
  名称：

  A New Way to Access Chiral Liquid Crystals: Organocatalyst-Mediated Synthesis of Chiral Rod-Like Liquid Crystals

  摘要：

  In this article, an asymmetric organocatalytic way to prepare chiral liquid crystals from non-chiral starting materials was described. By using L-proline as the organocatalyst, several new chiral rod-like liquid crystals that are elusive with traditional methods were prepared. In addition, a series of novel enone-containing rod-like liquid crystals were also obtained as side-products. Mesomorphic properties of all new compounds were studied by Polarized Optical Microscope and Differential Scanning Calorimetry.

  DOI：

  10.1080/15421406.2011.570138