1-氟-6-丙基-2-(3,4,5-三氟苯基)萘 | 247924-99-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 中文名称: 1-氟-6-丙基-2-(3,4,5-三氟苯基)萘
• 英文名称: 1-Fluoro-2-(3,4,5-trifluorophenyl)-6-propylnaphthalene
• 英文别名: Naphthalene, 1-fluoro-6-propyl-2-(3,4,5-trifluorophenyl)-；1-fluoro-6-propyl-2-(3,4,5-trifluorophenyl)naphthalene
• CAS: 247924-99-8
• 化学式: C₁₉H₁₄F₄
• 分子量: 318.314
• InChiKey: CBXGVGSJJIJMHL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.5
• 重原子数：
  23
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  6-丙基-2-萘酚 在 四(三苯基膦)钯 三氟甲磺酸 、 N,N’-difluoro-2,2’-bipyridinium bis(tetrafluoroborate) 作用下， 以 二氯甲烷 为溶剂， 生成 1-氟-6-丙基-2-(3,4,5-三氟苯基)萘
  参考文献：
  名称：

  Design, Synthesis and Physical Properties of New Liquid Crystal Materials for Active Matrix LCD (2)

  摘要：

  Novel 1-fluoro- and 1,2-difluoronaphthalene derivatives were designed for active matrix LCD and were prepared through the regioselective fluorination of 6-substituted 2-naphthols. These compounds exhibited high nematic-isotropic transition temperatures with very large dielectric anisotropy and large birefringences. These results are useful for design of new liquid crystal mixtures for TFT-displays.

  DOI：

  10.1080/10587250108025059

文献信息

• LIQUID CRYSTAL COMPOUND HAVING CHLORONAPHTHALENE MOIETY, LIQUID CRYSTAL COMPOSITION, AND OPTICAL DEVICE
  申请人：HASEBA Yasuhiro

  公开号：US20090065739A1

  公开（公告）日：2009-03-12

  A compound represented by formula (1): wherein R 1 is hydrogen or alkyl having 1 to 20 carbons, in which in the alkyl, arbitrary —CH 2 — may be replaced by —O—, —S—, —COO—, —CH═CH— or —C≡C—, and arbitrary hydrogen may be replaced by halogen or alkyl having 1 to 3 carbons; ring A 1 , ring A 2 , ring A 3 , ring A 4 and ring A 5 are each independently a benzene ring, a piperidine ring, a tetrahydropyrane ring or a dioxane ring, in which in the rings, arbitrary hydrogen may be replaced by halogen, alkyl having 1 to 3 carbons, alkoxy having 1 to 3 carbons or halogenated alkyl having 1 to 3 carbons, and —CH═ may be replaced by —N═; Z 1 , Z 2 , Z 4 , Z 5 and Z 6 are each independently a single bond, —COO— or —CF 2 O—; Z 3 is a single bond or —CF 2 O—, and in the case where Z 3 is a single bond, ring A 3 is a ring represented by formula (RG-5), or L 1 and L 2 are both fluorine, or at least one of Z 1 , Z 2 , Z 4 , Z 5 and Z 6 is —CF 2 O—; L 1 , L 2 , L 3 and L 4 are each independently hydrogen or halogen; X 1 is hydrogen, halogen, —C≡N, —N═C═S, —C≡C—C≡N, —SF 5 or alkyl having 1 to 10 carbons, in which in the alkyl, arbitrary —CH 2 — may be replaced by —O—, —S—, —CH═CH— or —C≡C—, and arbitrary hydrogen may be replaced by halogen; and 1, m, n, o and p are each independently 0 or 1, provided that l+m+n+o+p≦4:

  化合物的化学式为(1):其中R1是氢原子或具有1至20个碳的烷基，其中在烷基中，任意的—CH2—可以被—O—，—S—，—COO—，—CH═CH—或—C≡C—所取代，并且任意的氢可以被卤素或具有1至3个碳的烷基所取代；环A1，环A2，环A3，环A4和环A5分别独立地是苯环，哌啶环，四氢吡喃环或二噁烷环，在环中，任意的氢可以被卤素，具有1至3个碳的烷基，具有1至3个碳的烷氧基或卤代的具有1至3个碳的烷基所取代，而—CH═可以被—N═所取代；Z1，Z2，Z4，Z5和Z6分别独立地是单键，—COO—或—CF2O—；Z3是单键或—CF2O—，在Z3为单键的情况下，环A3是由(RG-5)式所表示的环，或L1和L2都是氟原子，或Z1，Z2，Z4，Z5和Z6中至少有一个是—CF2O—;L1，L2，L3和L4分别独立地是氢原子或卤素；X1是氢原子，卤素，—C≡N，—N═C═S，—C≡C—C≡N，—SF5或具有1至10个碳的烷基，在烷基中，任意的—CH2—可以被—O—，—S—，—CH═CH—或—C≡C—所取代，并且任意的氢可以被卤素所取代；而1，m，n，o和p独立地为0或1，但要求l+m+n+o+p≦4。
• Naphthalene derivative and liquid crystal composition comprising the same
  申请人：Dainippon Ink and Chemicals, Inc.

  公开号：US20030136944A1

  公开（公告）日：2003-07-24

  Disclosed in a novel liquid-crystalline compound which is a naphthalene derivative useful as an electro-optical liquid crystal display material, a liquid crystal composition containing such naphthalene derivatives and a liquid crystal display device comprising the same. The naphthalene derivative provided by the present invention exhibits an excellent liquid-crystallinity and miscibility with currently widely used liquid crystal compositions or compositions. The addition of the naphthalene derivative makes it possible to drastically lower the threshold voltage of the liquid crystal composition while maintaining its high response. The naphthalene derivative of the present invention is characterized by a large birefringence index. Further, most of the naphthalene derivative of the present invention has no strongly polar group in its molecule and thus can also be used for active matrix driving. Moreover, as shown in the foregoing examples, the naphthalene derivative of the present invention can be easily produced and is colorless and chemically stable. Accordingly, the liquid crystal composition comprising the naphthalene derivative of the present invention is extremely useful as a practical liquid crystal composition, particularly a liquid crystal composition which can operate within a wide temperature range and requires a high speed response and a low voltage driving.

  本发明揭示了一种新型液晶化合物，该化合物是萘衍生物，可用作电光液晶显示材料，液晶组合物包含这种萘衍生物，以及包含它的液晶显示装置。本发明提供的萘衍生物表现出优异的液晶性和与目前广泛使用的液晶组合物或配方的混溶性。添加萘衍生物可以在保持高响应的同时大幅降低液晶组合物的阈值电压。本发明的萘衍生物具有较大的双折射率指数。此外，大多数本发明的萘衍生物分子中没有强极性基团，因此也可用于有源矩阵驱动。此外，正如前面的例子所示，本发明的萘衍生物可以很容易地制备，无色且化学稳定。因此，包含本发明的萘衍生物的液晶组合物非常有用作为实用的液晶组合物，特别是需要在广泛的温度范围内工作并需要高速响应和低电压驱动的液晶组合物。
• Liquid crystal compound having chloronaphthalene moiety, liquid crystal composition, and optical device
  申请人：Chisso Corporation

  公开号：EP2028252A1

  公开（公告）日：2009-02-25

  A compound represented by formula (1): wherein R1 is hydrogen or alkyl having 1 to 20 carbons, in which in the alkyl, arbitrary -CH2- may be replaced by -O-, -S-, -COO-, -CH=CH- or -C≡C-, and arbitrary hydrogen may be replaced by halogen or alkyl having 1 to 3 carbons; ring A1, ring A2, ring A3, ring A4 and ring A5 are each independently a benzene ring, a piperidine ring, a tetrahydropyrane ring or a dioxane ring, in which in the rings, arbitrary hydrogen may be replaced by halogen, alkyl having 1 to 3 carbons, alkoxy having 1 to 3 carbons or halogenated alkyl having 1 to 3 carbons, and -CH= may be replaced by -N=; Z1, Z2, Z4, Z5 and Z6 are each independently a single bond, -COO- or -CF2O-; Z3 is a single bond or -CF2O-, and in the case where Z3 is a single bond, ring A3 is a ring represented by formula (RG-5), or L1 and L2 are both fluorine, or at least one of Z1, Z2, Z4, Z5 and Z6 is -CF2O-; L1, L2, L3 and L4 are each independently hydrogen or halogen; X1 is hydrogen, halogen, -C=N, -N=C=S, -C≡C-C≡N, -SF5 or alkyl having 1 to 10 carbons, in which in the alkyl, arbitrary -CH2- may be replaced by -O-, -S-, -CH=CH- or -C≡C-, and arbitrary hydrogen may be replaced by halogen; and 1, m, n, o and p are each independently 0 or 1, provided that 1+m+n+o+p ≤ 4:

  式 (1) 所代表的化合物： 其中 R1 是氢或具有 1 至 20 个碳原子的烷基，在烷基中，任意的-CH2-可被-O-、-S-、-COO-、-CH=CH-或-C≡C-取代，任意的氢可被卤素或具有 1 至 3 个碳原子的烷基取代；环 A1、环 A2、环 A3、环 A4 和环 A5 分别独立地为苯环、哌啶环、四氢吡喃环或二氧环，其中，在这些环中，任意氢可被卤素、1 至 3 个碳原子的烷基、1 至 3 个碳原子的烷氧基或 1 至 3 个碳原子的卤代烷基取代，-CH= 可被-N= 取代；Z1、Z2、Z4、Z5 和 Z6 各自独立地是单键、-COO- 或 -CF2O-；Z3 是单键或 -CF2O-，在 Z3 是单键的情况下，环 A3 是式 (RG-5) 所代表的环，或 L1 和 L2 都是氟，或 Z1、Z2、Z4、Z5 和 Z6 中至少有一个是 -CF2O-；L1、L2、L3 和 L4 各自独立地是氢或卤素；X1是氢、卤素、-C=N、-N=C=S、-C≡C-C≡N、-SF5或具有1至10个碳原子的烷基，其中在烷基中，任意的-CH2-可被-O-、-S-、-CH=CH-或-C≡C-取代，任意的氢可被卤素取代；以及1、m、n、o和p各自独立地为0或1，条件是1+m+n+o+p≤4：
• NEMATIC LIQUID CRYSTAL COMPOSITION AND BISTABLE NEMATIC LIQUID CRYSTAL DISPLAY
  申请人：DIC Corporation

  公开号：EP2147080B1

  公开（公告）日：2014-04-30
• NEMATIC LIQUID CRYSTAL COMPOSITION AND BISTABLE NEMATIC LIQUD CRYSTAL DISPLAY
  申请人：Nakata Hidetoshi

  公开号：US20100201930A1

  公开（公告）日：2010-08-12

  The present invention provides a nematic liquid crystal composition suitable for a bistable nematic liquid crystal display. A bistable nematic liquid crystal display having a wide nematic phase temperature range and operating temperature range can be obtained by using a nematic liquid crystal composition comprising at least 20% by weight of a specific liquid crystal compound (A) having a polar group and 5 to 50% by weight of a specific liquid crystal compound (B) not having a polar group, along with comprising, in the compound (B), at least 3% by weight of a specific liquid crystal compound having a alkenyl group.