6-[2,3-difluoro-4-[4-(trans-4-pentylcyclohexyl)phenyl]phenyloxy]hexanoic acid | 1154762-00-1

• 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: 6-[2,3-difluoro-4-[4-(trans-4-pentylcyclohexyl)phenyl]phenyloxy]hexanoic acid
• 英文别名: 6-((4’-(trans-4-pentylcyclohexyl)-[1,1‘-biphenyl]-4-yl)oxy)hexanoic acid
• CAS: 1154762-00-1
• 化学式: C₂₉H₄₀O₃
• 分子量: 436.635
• InChiKey: IKEIRHAALBZKCR-RQNOJGIXSA-N

物化性质

• 沸点：
  598.2±50.0 °C(predicted)
• 密度：
  1.029±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  8.23
• 重原子数：
  32.0
• 可旋转键数：
  13.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  46.53
• 氢给体数：
  1.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  6-[2,3-difluoro-4-[4-(trans-4-pentylcyclohexyl)phenyl]phenyloxy]hexanoic acid 在 氯化亚砜 作用下， 反应 3.0h， 生成
  参考文献：
  名称：

  Yoshio, Masafumi; Shoji, Yoshiko; Tochigi, Yusuke, Journal of the American Chemical Society, 2009, vol. 131, p. 6763 - 6767

  摘要：

  DOI：
• 作为产物：
  描述：

  6-[4-[4-(trans-4-pentylcyclohexyl)phenyl]phenyloxy]hexanoic acid ethyl ester 在 氢氧化钾 、 盐酸 作用下， 以 乙醇 、 水 为溶剂， 反应 1.0h， 以95%的产率得到6-[2,3-difluoro-4-[4-(trans-4-pentylcyclohexyl)phenyl]phenyloxy]hexanoic acid
  参考文献：
  名称：

  Yoshio, Masafumi; Shoji, Yoshiko; Tochigi, Yusuke, Journal of the American Chemical Society, 2009, vol. 131, p. 6763 - 6767

  摘要：

  DOI：

文献信息

• [EN] PHOTOCHROMIC INDENO FUSED PHENANTHRENOPYRAN COMPOUNDS<br/>[FR] COMPOSÉS DE PHÉNANTHRÉOPYRANE INDÉNO-FUSIONNÉS PHOTOCHROMIQUES
  申请人：TRANSITIONS OPTICAL LTD

  公开号：WO2018206096A1

  公开（公告）日：2018-11-15

  The present invention relates to photochromic indeno fused phenanthrenopyran compounds represented by the following Formula (I). With some embodiments, the photochromic compounds represented by Formula (I) include at least one lengthening group (e.g., R6 and/or R7 each independently being a lengthening group) and the compounds of the present invention are photochromicdichroic compounds. The present invention also relates to photochromic compositions and photochromic articles, such as photochromic ophthalmic articles that include one or more photochromic compounds represented by Formula (I).

  本发明涉及由以下式（I）表示的光致变色的吲哚螺芴并联苯并吡喃化合物。在某些实施例中，由式（I）表示的光致变色化合物包括至少一个延长基团（例如，R6和/或R7分别独立地是一个延长基团），本发明的化合物是光致变色二向性化合物。本发明还涉及光致变色组合物和光致变色物品，例如包括由式（I）表示的一个或多个光致变色化合物的光致变色眼科物品。
• Photochromic Indeno Fused Phenanthrenopyran Compounds
  申请人：Transitions Optical, Ltd.

  公开号：US20200048216A1

  公开（公告）日：2020-02-13

  The present invention relates to photochromic indeno fused phenanthrenopyran compounds represented by the following Formula (I). With some embodiments, the photochromic compounds represented by Formula (I) include at least one lengthening group (e.g., R 6 and/or R 7 each independently being a lengthening group) and the compounds of the present invention are photochromicdichroic compounds. The present invention also relates to photochromic compositions and photochromic articles, such as photochromic ophthalmic articles that include one or more photochromic compounds represented by Formula (I).