2-isopropyl-5-methylphenyl biphenyl-4-carboxylate | 300361-82-4

• 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: 2-isopropyl-5-methylphenyl biphenyl-4-carboxylate
• 英文别名: 5-Methyl-2-(propan-2-yl)phenyl biphenyl-4-carboxylate；(5-methyl-2-propan-2-ylphenyl) 4-phenylbenzoate
• CAS: 300361-82-4
• 化学式: C₂₃H₂₂O₂
• 分子量: 330.426
• InChiKey: WIZVKNOUIYOAEW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  25
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  百里酚 、 4-苯基苯甲酸 在 4-二甲氨基吡啶 、 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 作用下， 以 二氯甲烷 为溶剂， 以74%的产率得到2-isopropyl-5-methylphenyl biphenyl-4-carboxylate
  参考文献：
  名称：

  Modulation of thermo-transient receptor potential (thermo-TRP) channels by thymol-based compounds

  摘要：

  A series of thirty-three thymol, p-cymene-3-carboxylic acid, and 3-amino-p-cymene derivatives was synthesized and tested on TRPA1, TRPM8, and TRPV3 channels. Most of them acted as strong modulators of TRPA1, TRPM8, and TRPV3 channels with EC50 and/or IC50 values distinctly lower than those of thymol and related monoterpenoids. Some of the compounds examined, that is, 3c, 4e, f, 6b, and 8b exhibited an appreciable subtype-selectivity. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.03.055

文献信息

• Catalytic π–π Interactions Triggered Photoinduced Synthesis of Biaryls
  作者：Vishal Jyoti Roy、Janardan Chakraborty、Sudipta Raha Roy

  DOI：10.1021/acs.orglett.3c03806

  日期：——

  A highly regioselective photocatalytic method to access a variety of biaryl motifs under metal-free conditions has been developed. The organophotocatalyst is involved in π–π stacking interactions with the alkyne species, which promotes this photocatalytic process with thiophene. Mechanistic studies have shed light on these interactions and the overall process. Along with a broad functional-group tolerance

  已经开发出一种在无金属条件下获取各种联芳基图案的高度区域选择性光催化方法。有机光催化剂参与与炔烃的π-π堆积相互作用，从而促进了与噻吩的光催化过程。机理研究揭示了这些相互作用和整个过程。除了广泛的官能团耐受性和出色的区域选择性外，该方案已用于药物和其他天然产物的后期功能化。