4-(TRANS-4-PENTYLCYCLOHEXYL) PHENYL BORONIC ACID | 143651-26-7

• 物质功能分类: 化学试剂 - 有机试剂 - 硼酸
• 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: 4-(TRANS-4-PENTYLCYCLOHEXYL) PHENYL BORONIC ACID
• 英文别名: 4-(trans-4-pentylcyclohexyl)phenylboronic acid；(4-(4-pentylcyclohexyl)phenyl)boronic acid；(4-(trans-4-n-pentylcyclohexyl)phenyl)B(OH)2
• CAS: 143651-26-7
• 化学式: C₁₇H₂₇BO₂
• 分子量: 274.211
• InChiKey: JFESOTHKCUMHGA-SHTZXODSSA-N

物化性质

• 沸点：
  421.1±38.0 °C(Predicted)
• 密度：
  1.01

计算性质

• 辛醇/水分配系数(LogP)：
  3.22
• 重原子数：
  20.0
• 可旋转键数：
  6.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  40.46
• 氢给体数：
  2.0
• 氢受体数：
  2.0

安全信息

• 海关编码：
  2931900090
• 危险性防范说明：
  P280,P305+P351+P338
• 危险性描述：
  H302

SDS

Material Safety Data Sheet

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Section 1. Identification of the substance
Product Name: 4-(trans-4-Pentylcyclohexyl)phenylboronic acid
Synonyms:

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Section 2. Hazards identification
Harmful by inhalation, in contact with skin, and if swallowed.

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Section 3. Composition/information on ingredients.
Ingredient name: 4-(trans-4-Pentylcyclohexyl)phenylboronic acid
CAS number: 143651-26-7

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Section 4. First aid measures
Skin contact: Immediately wash skin with copious amounts of water for at least 15 minutes while removing
contaminated clothing and shoes. If irritation persists, seek medical attention.
Eye contact: Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate
flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical
attention.
Inhalation: Remove to fresh air. In severe cases or if symptoms persist, seek medical attention.
Ingestion: Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.

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Section 5. Fire fighting measures
In the event of a fire involving this material, alone or in combination with other materials, use dry
powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus
should be worn.

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Section 6. Accidental release measures
Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national
standards.
Respiratory precaution: Wear approved mask/respirator
Hand precaution: Wear suitable gloves/gauntlets
Skin protection: Wear suitable protective clothing
Eye protection: Wear suitable eye protection
Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container
for disposal. See section 12.
Environmental precautions: Do not allow material to enter drains or water courses.

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Section 7. Handling and storage
Handling: This product should be handled only by, or under the close supervision of, those properly qualified
in the handling and use of potentially hazardous chemicals, who should take into account the fire,
health and chemical hazard data given on this sheet.
Store in closed vessels.
Storage:

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Section 8. Exposure Controls / Personal protection
Engineering Controls: Use only in a chemical fume hood.
Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles.
General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse.

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Section 9. Physical and chemical properties
Appearance: Not specified
Boiling point: No data
No data
Melting point:
Flash point: No data
Density: No data
Molecular formula: C17H27BO2
Molecular weight: 274.2

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Section 10. Stability and reactivity
Conditions to avoid: Heat, flames and sparks.
Materials to avoid: Oxidizing agents.
Possible hazardous combustion products: Carbon monoxide.

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Section 11. Toxicological information
No data.

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Section 12. Ecological information
No data.

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Section 13. Disposal consideration
Arrange disposal as special waste, by licensed disposal company, in consultation with local waste
disposal authority, in accordance with national and regional regulations.

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Section 14. Transportation information
Non-harzardous for air and ground transportation.

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Section 15. Regulatory information
No chemicals in this material are subject to the reporting requirements of SARA Title III, Section
302, or have known CAS numbers that exceed the threshold reporting levels established by SARA
Title III, Section 313.

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SECTION 16 - ADDITIONAL INFORMATION
N/A

反应信息

• 作为反应物：
  描述：

  4-(TRANS-4-PENTYLCYCLOHEXYL) PHENYL BORONIC ACID 、 1-溴-3-氟-4-碘苯 在 四(三苯基膦)钯 sodium carbonate 作用下， 以 乙醇 、 水 、 苯 为溶剂， 反应 37.0h， 以67.8%的产率得到4-bromo-2-fluoro-4'-(trans-4-pentylcyclohexyl)biphenyl
  参考文献：
  名称：

  Polymerizable compound, polymerizable resin composition, cured polymer and liquid crystal display device

  摘要：

  这项发明的可聚合化合物由通式（I）表示：其中R为H，R′，R′O，R′COO或R′OCO，R′为具有1至约15个碳原子的直链或支链烷基或烯基基团，A1和A2分别为环己烷环或苯环，可能包括下面通式（II）表示的取代基；X为H或CH3；Y1、Y2、Y3和Y4独立地为H、F、Cl、CH3、CH3O、CF3或CF3O，其中至少两个Y1、Y2、Y3和Y4为H，如果A1和A2均为环己烷环，则至少有一个Y1、Y2、Y3和Y4不为H：其中Y5、Y6、Y7和Y8独立地为H、F、Cl、CH3、CH3O、CF3或CF3O，至少两个Y5、Y6、Y7和Y8为H。

  公开号：

  US06388146B1
• 作为产物：
  描述：

  1-Bromo-4-(Trans-4-n-Pentylcyclohexyl)Benzene 在 magnesium 、 硼酸三甲酯 作用下， 以 四氢呋喃 为溶剂， 反应 7.0h， 以52%的产率得到4-(TRANS-4-PENTYLCYCLOHEXYL) PHENYL BORONIC ACID
  参考文献：
  名称：

  在手性向列液晶反应场中合成的原纤维束中没有形态学的高度扭曲螺旋聚乙炔

  摘要：

  我们通过将苯基环己基 (PCH) 介晶部分取代到联萘环的 2,2' 位置或 2,2',6,6' 位置，合成了具有高度扭曲能力的新型轴向手性联萘衍生物。二取代和四取代的联萘衍生物，分别缩写为 D-1 和 D-2，被用作手性掺杂剂以诱导可用于合成螺旋聚乙炔的手性向列液晶（N*-LC）。D-2 的螺旋扭曲力 (betaM) 是 449 microm(-1)，这是 ca。比 D-1 大 2.6 倍（171 microm(-1)）。我们通过将手性掺杂剂 D-1 和 D-2 分别添加到宿主 N-LC 中，制备了两种螺旋间距为 5 microm 和 270 nm 的诱导 N*-LC。在含有 D-2 的 N*-LC 中合成的螺旋聚乙炔表现出高度螺旋状的原纤维，但不是一束原纤维。这一结果与通常的原纤维形态形成鲜明对比，其中螺旋状原纤维聚集形成原纤维束，如在 N*-LC 中合成的螺旋聚乙炔中观察到的那样，其中

  DOI：

  10.1021/ja070701x

文献信息

• 2-fluoropyrazines process for their preparation, and their use in
  申请人：Hoechst Aktiengesellschaft

  公开号：US05562859A1

  公开（公告）日：1996-10-08

  2-Fluoropyrazines, process for their preparation, and their use in liquid-crystalline mixtures A 2-fluoropyrazine of the formula (I) ##STR1## in which the symbols have the following meanings: R.sup.1 and R.sup.2, independently of one another, are, for example, H or straight-chain or branched alkyl, A.sup.1, A.sup.2, A.sup.3 and A.sup.4 are identical or different and are, for example, 1,4-phenylene or M.sup.1, M.sup.2, M.sup.3 and M.sup.4 are identical or different and are, for example, --0-- or --CO--O--, R.sup.3, R.sup.4, R.sup.6 and R.sup.7, independently of one another, are, for example, H or straight-chain or branched alkyl, M.sup.5 is, for example, --O--CO-- or a single bond, k, l, m, n, o, p, q and r are zero or one, with the condition that the sum of k+m+p+r is less than 4 and greater than zero, can advantageously be employed as a component in liquid-crystal mixtures.

  2-氟吡嗪的制备方法及其在液晶混合物中的应用 具有公式(I)的2-氟吡嗪 其中符号具有以下含义：R1和R2，彼此独立，例如，是H或直链或支链烷基，A1，A2，A3和A4相同或不同，例如，是1,4-苯基或M1，M2，M3和M4相同或不同，例如，是--O--或--CO--O--，R3，R4，R6和R7，彼此独立，例如，是H或直链或支链烷基，M5例如是--O--CO--或单一键，k，l，m，n，o，p，q和r是零或一，条件是k+m+p+r之和小於4且大於零，可用作液晶混合物的组分。
• 化合物及びその用途
  申请人：国立大学法人大阪大学

  公开号：JP2019064927A

  公开（公告）日：2019-04-25

  【課題】 単分子膜の機能を充分に発揮する方法を提供する。【解決手段】 下記一般式（１）で表されることを特徴とする化合物である。Ａ−Ｂ−Ｃ−Ｌ （１）（式中、Ａ及びＣは、それぞれ、ヘテロ原子及び／又は環状構造基が結合していてもよい直鎖状の炭化水素基を表す。Ｂは、環状構造基を表す。Ｌは、−Ｐ（＝Ｏ）（ＯＲ）２、−Ｏ−Ｐ（＝Ｏ）（ＯＲ）２、−Ｓｉ（ＯＲ）３、又は、−ＳｉＤ３を表す。Ｒは、同一又は異なって、水素原子又は炭化水素基を表す。Ｄは、同一又は異なって、ハロゲン原子を表す。）【選択図】図１

  提供方法充分发挥单分子膜功能的化合物，其特征在于以下通式（1）所表示。A-B-C-L（1）（式中，A和C分别表示可以连接异原子和/或环状结构基的直链烃基。B表示环状结构基。L表示-P(=O)(OR)2、-O-P(=O)(OR)2、-Si(OR)3或-SiD3。R表示相同或不同的氢原子或烃基。D表示相同或不同的卤素原子。）【选图】图1
• Helical Nylons and Polyphthalamides Synthesized by Chiral Interfacial Polymerizations between Chiral Nematic Liquid Crystal and Water Layers
  作者：Jinwoo Park、Munju Goh、Kazuo Akagi

  DOI：10.1021/ma500515s

  日期：2014.5.13

  enable the synthesis of both helical aliphatic polyamide (nylon) and aromatic polyamide (polyphthalamide) and can control their spiral morphologies. In this study, we developed a novel polymerization method based on chiral interfacial polycondensation using a chiral nematic liquid crystal (N*-LC) layer and a water layer and, for the first time, succeeded in synthesizing helical nylons and polyphthalamides

  聚酰胺是使用最广泛的工程塑料之一。以尼龙为代表的脂肪族聚酰胺已经预先通过二酰氯的有机层和二胺的水层之间的界面聚合反应合成。但是，超过75年以来，尚无可聚合螺旋状脂肪族聚酰胺（尼龙）和芳香族聚酰胺（聚邻苯二甲酰胺）并能控制其螺旋形态的聚合方法的报道。在这项研究中，我们开发了一种使用手性向列液晶（N * -LC）层和水层的基于手性界面缩聚的新型聚合方法，并且首次成功地以单手合成螺旋型尼龙和聚邻苯二甲酰胺螺旋形态。通过选择用于制备N * -LC的手性掺杂剂的手性来控制螺旋聚酰胺的螺旋形态中的旋流方向。本合成方法应将使用N * -LC的不对称界面聚合的适用性扩展到各种类型的聚酰胺。
• 3-fluoropyridines, process for their preparation, and their use in
  申请人：Hoechst Aktiengesellschaft

  公开号：US05445763A1

  公开（公告）日：1995-08-29

  A 3-fluoropyridine of the formula (I) ##STR1## in which the symbols have the following meanings: R.sup.1 and R.sup.2, independently of one another, are, for example, H or straight-chain or branched alkyl, A.sup.1, A.sup.2, A.sup.3 and A.sup.4 are identical or different and are, for example, 1,4-phenylene, pyrazine-2,5-diyl or trans-1,4-cyclohexylene, M.sup.1, M.sup.2, M.sup.3 and M.sup.4 are identical or different and are, for example, --O-- or --CO--O--, R.sup.3, R.sup.4, R.sup.6 and R.sup.7, independently of one another are, for example, H or straight-chain or branched alkyl, M.sup.5 is for example, --O--CO-- or a single bond, k, l, m, n, o, p, q and r are zero or one, with the proviso that the sum k+m+p+r is less than 4 and greater than zero, can advantageously be employed as a component in ferroelectric liquid-crystal mixtures.

  式(I)中的3-氟吡啶，其中符号具有以下含义：R.sup.1和R.sup.2，独立地，例如为H或直链或支链烷基，A.sup.1、A.sup.2、A.sup.3和A.sup.4相同或不同，例如为1,4-苯撑基，吡嗪-2,5-二基或反-1,4-环己基，M.sup.1、M.sup.2、M.sup.3和M.sup.4相同或不同，例如为--O--或--CO--O--，R.sup.3、R.sup.4、R.sup.6和R.sup.7独立地为H或直链或支链烷基，M.sup.5例如为--O--CO--或单键，k、l、m、n、o、p、q和r为零或一，但须满足k+m+p+r的和小于4且大于零，可优选地用作铁电液晶混合物中的组分。
• Reversible Handedness Inversion and Circularly Polarized Light Reflection Tuning in Self‐Organized Helical Superstructures Using Visible‐Light‐Driven Macrocyclic Chiral Switches
  作者：Hao Wang、Yuqi Tang、Hari Krishna Bisoyi、Quan Li

  DOI：10.1002/anie.202216600

  日期：2023.2.13

  synthesized macrocyclic chiral photoswitches are capable of reversible photoisomerization driven by visible light. The photoswitches show enhanced helical twisting power (HTP) in liquid crystals and diverse HTP changes upon photoisomerization. The photoswitches with shorter substituents enable visible-light-driven handedness inversion of the self-assembled helical superstructures.

  合成的大环手性光开关能够在可见光驱动下进行可逆光异构化。光电开关在液晶中显示出增强的螺旋扭曲力 (HTP) 以及光异构化时的不同 HTP 变化。具有较短取代基的光电开关能够实现自组装螺旋超结构的可见光驱动的旋向反转。