5-(3,5-Ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione | 80393-36-8

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 5-(3,5-Ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione
• CAS: 80393-36-8
• 化学式: C₂₀H₂₆O₅
• 分子量: 346.423
• InChiKey: MMLLGZGZAQCFNX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  25
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  69.7
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  2,6-二叔丁基苯酚 在 三乙胺 作用下， 以 四氢呋喃 为溶剂， 反应 14.0h， 生成 5-(3,5-Ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione
  参考文献：
  名称：

  The condensation of dicarbonyl compounds with N-phenyltriazolinedione-dienone ylides derived from phenols: the facile preparation of novel quinone methides

  摘要：

  DOI：

  10.1021/ja00006a059

文献信息

• WILSON, R. MARSHALL;CHANTARASIRI, NUANPHUN, J. AMER. CHEM. SOC., 113,(1991) N, C. 2301-2302
  作者：WILSON, R. MARSHALL、CHANTARASIRI, NUANPHUN

  DOI：——

  日期：——
• Charge-transfer material and process for producing the same, electron-transfer agent, photoreceptor for electrophotography and organic electroluminescence element using said charge-transfer material
  申请人：Kiuchi Yasuyuki

  公开号：US20060134539A1

  公开（公告）日：2006-06-22

  A photosensitive layer contains an electron-transfer agent that makes use of a compound represented by the following general formula (1): wherein R 1 through R 4 are each independently selected from the group consisting of hydrogen, cyano, nitro, halogen, hydroxyl, alkyl, aryl, heterocyclic ring, ester, alkoxy, aralkyl, allyl, amide, amino, acyl, alkenyl, alkynyl, carboxyl, carbonyl, and carboxylic acid; X is selected from the group consisting of oxygen, sulfur, and ═C(CN) 2 ; and W is a 4- to 8-membered ring.
• US7195851B2
  申请人：——

  公开号：US7195851B2

  公开（公告）日：2007-03-27