3-(4-butoxyphenyl)-3-(4-methoxyphenyl)-10,12-dibromo-6-trifluoromethyl-13,13-dimethyl-3H,13H-indeno[2',3':3,4]naphtho[1,2-b]pyran | 1311274-86-8

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 黄酮类化合物
• 英文名称: 3-(4-butoxyphenyl)-3-(4-methoxyphenyl)-10,12-dibromo-6-trifluoromethyl-13,13-dimethyl-3H,13H-indeno[2',3':3,4]naphtho[1,2-b]pyran
• 英文别名: 3-(4-butoxyphenyl)-3-(4-methoxyphenyl)-10,12-dibromo-6-trifluromethyl-13,13-dimethyl-3H,13H-indeno[2',1':3,4]naphtho[1,2-b]pyran；17,19-Dibromo-5-(4-butoxyphenyl)-5-(4-methoxyphenyl)-21,21-dimethyl-10-(trifluoromethyl)-6-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,8(13),9,11,15(20),16,18-nonaene
• CAS: 1311274-86-8
• 化学式: C₄₀H₃₃Br₂F₃O₃
• 分子量: 778.503
• InChiKey: OTOFWINLWIMJCA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.6
• 重原子数：
  48
• 可旋转键数：
  7
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  27.7
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  8,10-dibromo-7,7-dimethyl-3-(trifluoromethyl)-7H-benzo[c]fluoren-5-yl acetate 在 盐酸 、 甲醇 、 4-十二烷基苯磺酸 、 水 作用下， 以 四氢呋喃 、 氯仿 为溶剂， 反应 12.0h， 生成 3-(4-butoxyphenyl)-3-(4-methoxyphenyl)-10,12-dibromo-6-trifluoromethyl-13,13-dimethyl-3H,13H-indeno[2',3':3,4]naphtho[1,2-b]pyran
  参考文献：
  名称：

  [EN] PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS
  [FR] COMPOSÉS ET COMPOSITIONS PHOTOCHROMIQUES

  摘要：

  本文描述的化合物通常包括一个吲哚并[2'，3'：3，4]萘并[1,2-b]吡喃结构。这些化合物可能因其光致变色性能而有用，并可用于某些光致变色组合物中。这些组合物可能进一步包括其他光致变色组分和/或材料。此外，这些化合物和/或组合物可能适用于制备某些光致变色物品。本文还描述了制备某些光致变色化合物、组合物和物品的方法。

  公开号：

  WO2012082506A1

文献信息

• PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS
  申请人：He Meng

  公开号：US20120156521A1

  公开（公告）日：2012-06-21

  Described herein are compounds generally comprising an indeno[2′,3′:3,4]naptho[1,2-b]pyran structure. Such compounds may be useful for their photochromic properties, and be used in certain photochromic compositions. Such compositions may further comprise other photochromic compositions and/or materials. Additionally, such compounds and/or compositions may be suitable for preparing certain photochromic articles. Also described herein are methods for preparing certain photochromic compounds, compositions, and articles.

  本文描述了一种通常包含indeno [2′，3′：3,4] naptho [1,2-b] pyran结构的化合物。这些化合物可能因其光致变色性质而有用，并可用于某些光致变色组合物中。这样的组合物可能进一步包括其他光致变色组合物和/或材料。此外，这些化合物和/或组合物可能适用于制备某些光致变色物品。本文还描述了制备某些光致变色化合物，组合物和物品的方法。
• INDENO- FUSED RING COMPOUNDS HAVING PHOTOCHROMIC PROPERTIES
  申请人：Transitions Optical, Inc.

  公开号：EP2651913A1

  公开（公告）日：2013-10-23
• INDENO-FUSED RING COMPOUNDS HAVING PHOTOCHROMIC PROPERTIES
  申请人：Transitions Optical, Inc.

  公开号：EP2651913B1

  公开（公告）日：2017-04-19
• Indeno-fused ring compounds
  申请人：He Meng

  公开号：US20110140056A1

  公开（公告）日：2011-06-16

  The present invention relates to compounds represented by the following Formulas (I) and (II), Ring-A of Formulas I and II can be, for example, an aryl group, and Q′ and Q′″ can each be independently selected from groups, such as, halogen, —OH, —CN, amine groups, amide groups, carboxylic acid ester groups, carboxylic acid groups, alkenyl groups, alkynyl groups, carbonate groups, sulfide groups, and sulfonic acid ester groups. The present invention also relates to photochromic compositions and photochromic articles that include one or more photochromic compounds, such as represented by Formula II.
• INDENO-FUSED RING COMPOUNDS
  申请人：He Meng

  公开号：US20120126185A1

  公开（公告）日：2012-05-24

  The present invention relates to compounds represented by the following Formulas (I) and (II), Ring-A of Formulas I and II can be, for example, an aryl group, and Q′ and Q′″ can each be independently selected from groups, such as, halogen, —OH, —CN, amine groups, amide groups, carboxylic acid ester groups, carboxylic acid groups, alkenyl groups, alkynyl groups, carbonate groups, sulfide groups, and sulfonic acid ester groups. The present invention also relates to photochromic compositions and photochromic articles that include one or more photochromic compounds, such as represented by Formula II.