[1,1'-biphenyl]-2,2'-diyl-O,O'-bis[5-methyl-2-(1-methylethyl)cyclohexyl]carbonic ester | 291782-00-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [1,1'-biphenyl]-2,2'-diyl-O,O'-bis[5-methyl-2-(1-methylethyl)cyclohexyl]carbonic ester
• 英文别名: [2-methoxy-6-[3-methoxy-2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxycarbonyloxyphenyl]phenyl] [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] carbonate
• CAS: 291782-00-8
• 化学式: C₃₆H₅₀O₈
• 分子量: 610.788
• InChiKey: WTFVEHISOVESAK-QTDZXXNUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.8
• 重原子数：
  44
• 可旋转键数：
  13
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  89.5
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  [1,1'-biphenyl]-2,2'-diyl-O,O'-bis[5-methyl-2-(1-methylethyl)cyclohexyl]carbonic ester 在 lithium aluminium tetrahydride 、 溶剂黄146 、 benzyltriethylammonium perbromide 、 zinc(II) chloride 作用下， 以 四氢呋喃 为溶剂， 反应 17.0h， 生成 6,6'-dibromo-2,2'-dihydroxy-3,3'-dimethoxybiphenyl
  参考文献：
  名称：

  6,6′-Dibromo-3,3′-dimethoxy-2,2′-dihydroxy-1,1′-biphenyl: preparation and resolution

  摘要：

  A pratical route to prepare the title biphenyl 1 starting from 3,3',2,2'-tetramethoxy- 1,1'-biphenyl 2 is described. Resolution of 1 was achieved by its conversion into the corresponding diastereomeric menthyl-dicarbonate. The absolute configuration of (P)-(+)-1 was confirmed by X-ray analysis of the related diastereomer, (C) 2000 Elsevier Science Ltd, All rights reserved.

  DOI：

  10.1016/s0957-4166(00)00121-x
• 作为产物：
  描述：

  (1R,2S,5R)-Menthyl chloroformate 、 3,3'-dimethoxy-1,1'-biphenyl-2,2'-diol 在 三乙胺 作用下， 以 苯 为溶剂， 反应 1.0h， 以88%的产率得到[1,1'-biphenyl]-2,2'-diyl-O,O'-bis[5-methyl-2-(1-methylethyl)cyclohexyl]carbonic ester
  参考文献：
  名称：

  6,6′-Dibromo-3,3′-dimethoxy-2,2′-dihydroxy-1,1′-biphenyl: preparation and resolution

  摘要：

  A pratical route to prepare the title biphenyl 1 starting from 3,3',2,2'-tetramethoxy- 1,1'-biphenyl 2 is described. Resolution of 1 was achieved by its conversion into the corresponding diastereomeric menthyl-dicarbonate. The absolute configuration of (P)-(+)-1 was confirmed by X-ray analysis of the related diastereomer, (C) 2000 Elsevier Science Ltd, All rights reserved.

  DOI：

  10.1016/s0957-4166(00)00121-x

文献信息

• 6,6′-Dibromo-3,3′-dimethoxy-2,2′-dihydroxy-1,1′-biphenyl: preparation and resolution
  作者：Giovanna Delogu、Davide Fabbri、Maria Antonietta Dettori、Gianluigi Casalone、Alessandra Forni

  DOI：10.1016/s0957-4166(00)00121-x

  日期：2000.5

  A pratical route to prepare the title biphenyl 1 starting from 3,3',2,2'-tetramethoxy- 1,1'-biphenyl 2 is described. Resolution of 1 was achieved by its conversion into the corresponding diastereomeric menthyl-dicarbonate. The absolute configuration of (P)-(+)-1 was confirmed by X-ray analysis of the related diastereomer, (C) 2000 Elsevier Science Ltd, All rights reserved.