1',1'-Diethyl-14,14-bis(4-methoxyphenyl)-21,21-di(propan-2-yl)spiro[15,22-dioxa-20-thiahexacyclo[15.7.0.02,10.03,8.011,16.019,23]tetracosa-1(24),2(10),3,5,7,11(16),12,17,19(23)-nonaene-9,4'-cyclohexane] | 1398416-72-2

• 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: 1',1'-Diethyl-14,14-bis(4-methoxyphenyl)-21,21-di(propan-2-yl)spiro[15,22-dioxa-20-thiahexacyclo[15.7.0.02,10.03,8.011,16.019,23]tetracosa-1(24),2(10),3,5,7,11(16),12,17,19(23)-nonaene-9,4'-cyclohexane]
• CAS: 1398416-72-2
• 化学式: C₅₀H₅₄O₄S
• 分子量: 751.042
• InChiKey: HBZAOLFMLGEULM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  15.2
• 重原子数：
  55
• 可旋转键数：
  8
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  62.2
• 氢给体数：
  0
• 氢受体数：
  5

文献信息

• CHROMENE COMPOUND, CURABLE COMPOSITION COMPRISING THE COMPOUND, AND OPTICAL ARTICLE INCLUDING A CURED BODY OF THE CURABLE COMPOSITION
  申请人：TOKUYAMA CORPORATION

  公开号：US20200190106A1

  公开（公告）日：2020-06-18

  A chromene compound having at least one indenonaphthopyran moiety which has a group forming a spiro ring together with the 13-position carbon atom and further an oligomer chain group selected from a polyalkylene oxide oligomer chain group having at least three recurring units and a polyester oligomer chain group having at least three recurring units, represented by the following formula and having reduced matrix dependence: wherein R 1 and R 2 are each a group which may have an oligomer chain group, the ring Z bonded to the 13-position carbon atom of the chromene compound is a Spiro ring group, and R 3 and R 4 are each an aryl group or heteroaryl group which may have an oligomer chain group. Preferably, the chromene compound has at least one oligomer chain group in the molecule.

  具有至少一个印苯并萘吡喃基团的色酮化合物，其中该基团与13位碳原子形成螺环，并且进一步具有从至少三个重复单元中选择的聚烷氧基寡聚物链基团和聚酯寡聚物链基团中的一个寡聚物链基团，由下式表示并具有降低的矩阵依赖性： 其中R1和R2是各自可能具有寡聚物链基团的基团，与色酮化合物的13位碳原子键合的环Z是螺环基团，而R3和R4是各自可能具有寡聚物链基团的芳基或杂环基团。最好，该色酮化合物在分子中至少具有一个寡聚物链基团。
• CHROMENE COMPOUND
  申请人：Takenaka Junji

  公开号：US20140054520A1

  公开（公告）日：2014-02-27

  A novel photochromic compound which develops a color of a neutral tint and has high color optical density, high fading speed and excellent durability. The present invention is a chromene compound having an indeno(2,1-f)naphtho(1,2-b)pyran structure as the basic skeleton in which a hetero ring having two hetero atoms including at least one sulfur atom is directly bonded to the 6-position and the 7-position of the indeno(2,1-f)naphtho(1,2-b)pyran structure via the hetero atom like the compound represented by the following formula (18).

  一种新型的光致变色化合物，可呈现出中性色调的颜色，具有高色彩光密度、高褪色速度和极好的耐久性。本发明是一种含有吲哚并[2,1-f]萘并[1,2-b]吡喃结构作为基本骨架的咔喃化合物，其中一个含有至少一个硫原子的杂环直接连接到吲哚并[2,1-f]萘并[1,2-b]吡喃结构的6位和7位上，就像以下式子（18）所表示的化合物。
• PHOTOCHROMIC CURABLE COMPOSITION, CURED PRODUCT THEREOF AND LAMINATE INCLUDING THE CURED PRODUCT
  申请人：TOKUYAMA CORPORATION

  公开号：US20160002524A1

  公开（公告）日：2016-01-07

  A curable composition which comprises a carbonate-based polymerizable monomer represented by the following formula, other polymerizable monomers and a photochromic compound, can be used even under high-temperature and high-humidity conditions without any problems and provides a cured product having excellent photochromic properties. wherein A and A′ are each a linear or branched alkylene group having 2 to 15 carbon atoms, “a” is an average value of 1 to 20, when there are a plurality of A's, A's may be the same or different, R 1 is a hydrogen atom or methyl group, and R 2 is a (meth)acryloyloxy group or hydroxyl group.

  可治愈组合物包括以下化学式所表示的碳酸酯基可聚合单体、其他可聚合单体和光致变色化合物，即使在高温高湿环境下也可以使用，而且提供具有出色光致变色性能的固化产物。其中，A和A'是具有2至15个碳原子的线性或支链烷基，"a"是1至20的平均值，当有多个A时，A可以相同或不同，R1是氢原子或甲基基团，R2是（甲基）丙烯酰氧基团或羟基。
• PHOTOCHROMIC CURABLE COMPOSITION
  申请人：Tokuyama Corporation

  公开号：EP3020734A1

  公开（公告）日：2016-05-18

  A photochromic curable composition comprising (A) a polymerizable monomer component that contains a (meth)acrylic polymerizable monomer (X), and (B) a photochromic compound, wherein the (meth)acrylic polymerizable monomer (X) is constituted by 80 to 97 parts by mass of a polyfunctional monomer (Xp) having not less than two (meth) acrylic groups in a molecule thereof, and 3 to 20 parts by mass of a monofunctional monomer (Xm) having one (meth) acrylic group in a molecule thereof, the monofunctional polymerizable monomer (Xm) is constituted by an epoxy group-containing monomer (Xm1) and an isocyanate group-containing monomer (Xm2), and the isocyanate group-containing monomer (Xm2) and the epoxy group-containing monomer (Xm1) are contained at a mass ratio of Xm2/Xm1 = 3 to 40.

  一种光致变色可固化组合物，包括(A)含有(甲基)丙烯酸可聚合单体(X)的可聚合单体组分，以及(B)光致变色化合物，其中(甲基)丙烯酸可聚合单体(X)由 80 至 97 份（按质量份）的多官能团单体(Xp)构成，在其分子中具有不少于两个(甲基)丙烯酸基团、单官能团可聚合单体（Xm）由 3 至 20 份（质量分数）的含环氧基单体 （Xm1）和含异氰酸酯基单体（Xm2）构成，而含异氰酸酯基单体（Xm2）和含环氧基单体 （Xm1）的质量分数分别为 80 至 97 份（质量分数）和 3 至 20 份（质量分数）的含一 个（甲基）丙烯酸基团的单官能团单体（Xm）构成。 含异氰酸酯基团单体（Xm2）和含环氧基团单体（Xm1）的质量比为 Xm2/Xm1 = 3 至 40。
• Photocurable resin composition
  申请人：TOKUYAMA CORPORATION

  公开号：US10884334B2

  公开（公告）日：2021-01-05

  To provide a photocurable resin composition comprising an N-vinyl amide compound, a polyfunctional (meth)acrylate monomer and a photopolymerization initiator and having excellent adhesion to an optical substrate and free from an appearance defect such as a crack or shrinkage and a laminate having a coat layer obtained by curing the photocurable resin composition.

  提供一种光固化树脂组合物，该组合物由 N-乙烯基酰胺化合物、多官能度（甲基）丙烯酸酯单体和光聚合引发剂组成，与光学基板具有良好的粘附性，且无裂纹或收缩等外观缺陷，还提供一种具有通过固化该光固化树脂组合物而获得的涂层的层压板。