1-chloromethyl-4-decyloxybenzene | 110482-74-1

• 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: 1-chloromethyl-4-decyloxybenzene
• 英文别名: 4-decyloxybenzyl chloride；p-decyloxybenzyl chloride；1-(chloromethyl)-4-decoxybenzene
• CAS: 110482-74-1
• 化学式: C₁₇H₂₇ClO
• 分子量: 282.854
• InChiKey: MNQYLAAEZPMFSK-UHFFFAOYSA-N

物化性质

• 沸点：
  376.4±17.0 °C(Predicted)
• 密度：
  0.976±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  6.9
• 重原子数：
  19
• 可旋转键数：
  11
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  9.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  1-chloromethyl-4-decyloxybenzene 在 lithium aluminium tetrahydride 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 四氢呋喃 、 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 31.0h， 生成 Carbamic acid, [2,2-bis[[4-(decyloxy)phenyl]methyl]-3-hydroxypropyl]-,1,1-dimethylethyl ester
  参考文献：
  名称：

  通过一维氢键基团的共价浇铸定义的双链低聚物

  摘要：

  由单体分子前体组成的氢键胶带用于定义相关低聚物设计的结构参数，这些低聚物以预定的组装模式编码。将这种“共价铸造”策略应用于由 2-amino-4,6-dichlorotriazine 表达的一维 H 键基序，可以设计出高亲和力双链分子链。二聚体、三聚体和四聚体双链体低聚物是通过迭代合成方案制备的，该方案涉及低聚（氨基三嗪）的顺序同源性。通过 (1)H NMR 稀释实验、等温滴定量热法 (ITC)、蒸汽压渗透法 (VPO) 在溶液中建立了同源低聚物的组装模式和链间亲和力，交叉杂交实验涉及通过薄层色谱法 (TLC) 分析染料标记的链，并通过 X 射线晶体学分析在固态下进行。从单体延伸到二聚体再到三聚体，每个单体的结合自由能 (-Delta G 度/n) 显着增加，表明强大的积极合作效应。Nanomolar 结合亲和力 (K(d) = 1.44 +/- 0.50 nM) 由 ITC 在 1,2-二氯乙烷中在

  DOI：

  10.1021/ja012696h
• 作为产物：
  描述：

  4-(癸基氧基)苯甲酸甲酯 在 lithium aluminium tetrahydride 、 氯化亚砜 作用下， 以 四氢呋喃 为溶剂， 反应 1.67h， 生成 1-chloromethyl-4-decyloxybenzene
  参考文献：
  名称：

  Smectic Bimetallomesogens: Synthesis and Mesomorphic Properties in Oxygen-Bridged Dicopper and Divanadyl Complexes

  摘要：

  AbstractThe synthesis and mesomorphic properties of a homologous series of N‐(3‐hydroxypropyl)‐4‐alkoxylsalicylaldimine, N‐(3‐hydroxypropyl)‐4‐(4′‐alkoxybenzoxy)salicylaldimine, and their dicopper(II) and di‐oxovanadium(VI) complexes are reported. Copper complexes exhibited monotropic smectic A phases; however, vanadyl complexes showed no mesomorphism. A systematic comparison revealed that the meso‐genie behaviors of these bimetallic complexes are induced by the weak intermolecular force and determined mainly by the central metal. The effects on the structural variations near the metal central cores and side chain density are also discussed.

  DOI：

  10.1002/jccs.199700014

文献信息

• Amphiphilic dendritic dipeptides & their self-assembly into helical pores
  申请人：Percec Virgil

  公开号：US20060088499A1

  公开（公告）日：2006-04-27

  An amphiphilic dendritic dipeptide, comprises a dipeptide(s) comprising one or more of a naturally occurring or synthetic amino acids and a dendron. These are suitable for use in various formulations, films, coatings, membranes and sensors, among other applications.

  一种两性树状二肽，包括一个或多个天然存在或合成氨基酸的二肽和一个树状结构。这些适用于各种配方、薄膜、涂层、膜和传感器等应用。
• Preparation of troponoid liquid crystals with a flexible oxymethylene linking unit
  作者：Akira Mori、Hisashi Taya、Hitoshi Takeshita、Seiji Ujiie

  DOI：10.1039/a704536k

  日期：——

  2-Benzyloxytropones, which have a saturated oxymethylene (–CH2O–) linking unit, show a monotropic smectic A phase while the corresponding alkoxybenzyl alkoxyphenyl ethers have poor mesogenic properties. The tropone carbonyl group acting as a dipolar lateral substituent enhances the smectic thermal stability.

  具有饱和氧亚甲基（-CH2O-）连接单元的 2-苄氧基托品呈现出单向晶相，而相应的烷氧基苄基烷氧基苯基醚则具有较差的中生特性。作为双极性横向取代基的托品羰基增强了共晶热稳定性。
• Amphiphilic dendritic dipeptides and their self-assembly into helical pores
  申请人：The Trustees of The University of Pennsylvania

  公开号：US07671033B2

  公开（公告）日：2010-03-02

  An amphiphilic dendritic dipeptide, comprises a dipeptide(s) comprising one or more of a naturally occurring or synthetic amino acids and a dendron. These are suitable for use in various formulations, films, coatings, membranes and sensors, among other applications.

  一种亲水疏水两性树枝二肽，包含一个由一种或多种天然或合成氨基酸组成的二肽和一个树枝。这些适用于各种配方、薄膜、涂层、膜和传感器等应用。
• Optically active liquid crystal compound having methyleneoxy group and composition containing same
  申请人：Chisso Corporation

  公开号：EP0212838A1

  公开（公告）日：1987-03-04

  A novel, superior, optically active liquid crystal compound exhibiting a smectic C* phase, and a liquid crystal composition containing the same are provided, which compound is expressed by the formula wherein X represents -CH₂O- or -OCH₂-; Y represents -COO- or -OCO-; and either one of R¹ or R² represents an optically active alkyl group, alkoxy group or alkoxycarbonyl group and the other thereof represents a non-optically-­active alkyl group or alkoxy group each of 4 to 18 carbon atoms.

  本发明提供了一种新型的、优异的、具有光学活性的液晶化合物，该化合物表现出一种共晶 C* 相，并提供了一种含有该化合物的液晶组合物，该化合物由式表示 其中 X 代表 -CH₂O- 或 -OCH₂-；Y 代表 -COO- 或 -OCO-；R¹ 或 R² 中的一个代表光学活性烷基、烷氧基或烷氧基羰基，另一个代表非光学活性烷基或烷氧基，每个烷基或烷氧基含有 4 至 18 个碳原子。
• Synthesis and mesomorphic properties of γ-substituted β-diketones and their dicarbonylrhodium(I) complexes
  作者：Jie Han、Liang Fu Zhang、Wen Wan

  DOI：10.1016/s0022-328x(03)00146-3

  日期：2003.4

  Five series of 3-(C10H21O-Ph-X-Ph-Y-) substituted pentane-2,4-diones and their dicarbonylrhodium(l) complexes, namely, series 1: X = -CH=CHCOO- and Y = -COO-, series 2: X -CH=CHCOO- and Y = -CH=CHCOO-, series 3: X = -COO- and Y = -CH=CHCOO-, series 4: X = -CH2O- and Y -COO-, series 5: X = -N=N- and Y = -COO-, have been synthesized, their mesogenic properties have been investigated using a Nikon polarizing microscope and DSC. It is found the beta-diketones 1a-3a, 5a and the complexes 1b-3b exhibit liquid crystal behaviors. The effect of the bridging groups of X and Y on the mesogenic properties of the ligands and the complexes has been explored. (C) 2003 Elsevier Science B.V. All rights reserved.