6-(benzyloxy)naphthalen-2-ol | 2041-17-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 6-(benzyloxy)naphthalen-2-ol
• 英文别名: 2-Hydroxy-6-benzyloxy-naphthalim；2-benzyloxy-6-hydroxynaphthalene；6-(benzyloxy)-2-naphthol；6-Benzyloxy-2-napthol；6-phenylmethoxynaphthalen-2-ol
• CAS: 2041-17-0
• 化学式: C₁₇H₁₄O₂
• 分子量: 250.297
• InChiKey: PAIJEAKYLMOHKI-UHFFFAOYSA-N

物化性质

• 熔点：
  133 °C
• 沸点：
  444.1±20.0 °C(Predicted)
• 密度：
  1.210±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  6-(benzyloxy)naphthalen-2-ol 在 potassium dihydrogenphosphate 、 potassium nitrososulfonate 作用下， 以 丙酮 为溶剂， 生成 6-Benzyloxy-naphthochinon-1,2
  参考文献：
  名称：

  Horner,L. et al., Chemische Berichte, 1965, vol. 98, p. 1233 - 1245

  摘要：

  DOI：
• 作为产物：
  描述：

  2-苄氧基-6-溴萘 生成 6-(benzyloxy)naphthalen-2-ol
  参考文献：
  名称：

  Horner,L. et al., Chemische Berichte, 1965, vol. 98, p. 1233 - 1245

  摘要：

  DOI：

文献信息

• Imine Macrocycle with a Deep Cavity: Guest-Selected Formation of<i>syn/anti</i>Configuration and Guest-Controlled Reconfiguration
  作者：Zhenfeng He、Gang Ye、Wei Jiang

  DOI：10.1002/chem.201405912

  日期：2015.2.9

  present article, we show how organic templates can efficiently transform a complex dynamic imine library into a dynamic imine macrocycle. Not only is the constitution well controlled, but also the syn/anti host configuration is efficiently selected and even the orientation of the guest in the asymmetric cavity of the host can be well aligned. This is attributed to the delicate balance and the cooperation

  动态共价键是构建大型且坚固的有机体系结构的理想链接之一。在本文中，我们展示了有机模板如何将复杂的动态亚胺文库有效地转化为动态亚胺大环。不仅可以很好地控制结构，而且可以有效地选择顺/反主体构型，甚至客体在主体不对称腔中的方向也可以很好地对齐。这归因于主人和客人之间微妙的平衡以及多种非共价相互作用的配合。通过以适当的数量顺序添加三个来宾，首次实现了对动态共价体系结构的受控结构重配置。
• Site‐selective Oxidative Dearomatization of Phenols and Naphthols into <i>ortho</i> ‐Quinols or Epoxy <i>ortho</i> ‐Quinols using Oxone as the Source of Dimethyldioxirane
  作者：María J. Cabrera‐Afonso、M. Carmen Carreño、Antonio Urbano

  DOI：10.1002/adsc.201900660

  日期：2019.10.8

  A novel reactivity of dimethyldioxirane, generated in situ from Oxone and acetone, with substituted phenols and naphthols is reported. This methodology allowed the synthesis of ortho‐quinols or epoxy ortho‐quinols from a site‐selective oxidative dearomatization process, with good yields under very mild conditions. A short total synthesis of natural product lacinilene C methyl ether is also described

  报道了由Oxone和丙酮原位生成的二甲基二环氧乙烷与取代的酚和萘的新型反应性。该方法允许合成邻-quinols或环氧邻-quinols从站点选择性氧化脱芳构化过程中，随着非常温和的条件下具有良好的产率。还描述了使用该方法作为关键步骤的天然产物紫杉烯C甲醚的短暂全合成。
• Compounds
  申请人：Astra Pharmaeuticals Ltd.

  公开号：US05977105A1

  公开（公告）日：1999-11-02

  A compound of formula I, ##STR1## wherein--X represents (CH.sub.2).sub.n O, (CH.sub.2).sub.n S or C.sub.2 alkylene; n represents 1 or 2; Ar.sup.1 represents indanyl, tetrahydronaphthyl, naphthyl or phenyl, which latter two groups may be substituted by one or more substituents selected from chloro, fluoro, OR.sup.1, O(CH.sub.2).sub.m CONR.sup.20 R.sup.21, C(O)R.sup.2, C.sub.1-6 alkyl (optionally substituted by one or more fluorine atoms), pyridyl, thiazinyl, phenyl or C.sub.7-9 alkylphenyl which latter two groups are optionally substituted by one or more substituent selected from halo, nitro, OR.sup.3, C.sub.1-6 alkyl (optionally substituted by one or more fluorine atoms), C(O)R.sup.4, C(O)OR.sup.5, C(O)N(R.sup.6)R.sup.7, CN, CH.sub.2 OR.sup.14, CH.sub.2 NR.sup.15 R.sup.16, N(R.sup.8)R.sup.9, N(R.sup.10)SO.sub.2 R.sup.11, N(R.sup.12)C(O)R.sup.13, OC(O)R.sup.19 and SO.sub.2 NR.sup.17 R.sup.18 ; m represents an integer 1 to 3; R.sup.1, R.sup.2 and R.sup.3 independently represent H, C.sub.1-10 alkyl (optionally substituted by one or more fluorine atoms), C.sub.7-9 alkylphenyl or phenyl, which latter group is optionally substituted by hydroxy; and R.sup.4, R.sup.5, R.sup.6, R.sup.7, R.sup.8, R.sup.9, R.sup.10, R.sup.11, R.sup.12, R.sup.13, R.sup.14, R.sup.15, R.sup.16, R.sup.17, R.sup.18, R.sup.19, R.sup.20 and R.sup.21 independently represent H, C.sub.1-6 alkyl (optionally substituted by one or more fluorine atoms) or phenyl; in which any alkyl group present may be interrupted by one or more oxygen atoms; provided that when X represents CH.sub.2 CH.sub.2, Ar.sup.1 may not represent phenyl or phenyl substituted with one or more substituents OR.sup.1, in which R.sup.1 represents C.sub.1-10 alkyl; or a pharmaceutically acceptable derivative thereof, may be used for the treatment of a reversible obstructive airways disease or allergic conditions of the skin, nose and eye.

  一种具有以下结构式I的化合物，其中--X代表(CH₂)ₙO，(CH₂)ₙS或C₂烷基；n代表1或2；Ar¹代表茚基、四氢萘基、萘基或苯基，后两种基团可以被来自氯、氟、OR¹、O(CH₂)ₘCONR²⁰R²¹、C(O)R²、C₁-₆烷基（可选地被一个或多个氟原子取代）、吡啶基、噻唑基、苯基或C₇-₉烷基苯基的一个或多个取代基所取代；后两种基团可以被来自卤素、硝基、OR³、C₁-₆烷基（可选地被一个或多个氟原子取代）、C(O)R⁴、C(O)OR⁵、C(O)N(R⁶)R⁷、CN、CH₂OR¹⁴、CH₂NR¹⁵R¹⁶、N(R⁸)R⁹、N(R¹⁰)SO₂R¹¹、N(R¹²)C(O)R¹³、OC(O)R¹⁹和SO₂NR¹⁷R¹⁸所选取的一个或多个取代基所取代；m代表整数1到3；R¹、R²和R³独立地代表H、C₁-₁₀烷基（可选地被一个或多个氟原子取代）、C₇-₉烷基苯基或苯基，后一基团可选地被羟基取代；R⁴、R⁵、R⁶、R⁷、R⁸、R⁹、R¹⁰、R¹¹、R¹²、R¹³、R¹⁴、R¹⁵、R¹⁶、R¹⁷、R¹⁸、R¹⁹、R²⁰和R²¹独立地代表H、C₁-₆烷基（可选地被一个或多个氟原子取代）或苯基；其中任何存在的烷基基团可以被一个或多个氧原子中断；但是当X代表CH₂CH₂时，Ar¹不能代表苯基或被一个或多个取代基OR¹取代的苯基，其中R¹代表C₁-₁₀烷基；或其药学上可接受的衍生物，可用于治疗可逆性阻塞性气道疾病或皮肤、鼻子和眼睛的过敏症状。
• Dearomatizing [4+1] Spiroannulation of Naphthols: Discovery of Thermally Activated Delayed Fluorescent Materials
  作者：Wenbo Liang、Yudong Yang、Mufan Yang、Min Zhang、Chengming Li、You Ran、Jingbo Lan、Zhengyang Bin、Jingsong You

  DOI：10.1002/anie.202012842

  日期：2021.2.15

  Disclosed here is a palladium‐catalyzed direct [4+1] spiroannulation of ortho‐C−H bonds of naphthols with cyclic diaryliodonium salts to construct spirofluorenyl naphthalenones (SFNP) under mild reaction conditions. This spiroannulation directly transforms the hydroxy group into a carbonyl group, and also tolerates reactive functional groups such as the halo groups, which provide an opportunity to

  此处公开的是在温和的反应条件下，钯催化的萘并萘二酚与环二芳基碘鎓盐的邻位C-H键的直接[4 + 1]螺环化，以构建螺芴基萘酮（SFNP）。这种螺环化将羟基直接转化为羰基，还可以耐受反应性官能团，例如卤素基团，这为将具有羰基的结构新的热活化延迟荧光（TADF）材料与相邻的螺芴基快速组装提供了机会单位作为接受者。作为示例，使用组装的DMAC-SFNP的OLED器件因为主体材料显示出2.5 V的低启动电压和32.2％的超高外部量子效率。这项工作为结构上新颖的TADF材料提供了灵感，并展示了CH活化作为光电子材料创新的合成策略的潜力。
• Fluorine-containing chiral smectic liquid crystals
  申请人：Minnesota Mining and Manufacturing Company

  公开号：US05254747A1

  公开（公告）日：1993-10-19

  Compounds are provided which comprise a fluorocarbon terminal portion and a chiral hydrocarbon terminal portion, said terminal portions being connected by a central core, said compounds having tilted smectic mesophases or having latent tilted smectic mesophases which develop when said compounds having said latent mesophases are in admixture with said compounds having tilted smectic mesophases or said compounds having latent tilted smectic mesophases.

  提供的化合物包括氟碳末端部分和手性烃碳末端部分，这些末端部分通过中心核连接，这些化合物具有倾斜的薄层介相或具有潜在的倾斜薄层介相，当这些具有潜在倾斜薄层介相的化合物与具有倾斜薄层介相或具有潜在倾斜薄层介相的化合物混合时，这些化合物会产生。