p-acryloyloxybenzoyl chloride | 67362-78-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚酯
• 英文名称: p-acryloyloxybenzoyl chloride
• 英文别名: (4-carbonochloridoylphenyl) prop-2-enoate
• CAS: 67362-78-1
• 化学式: C₁₀H₇ClO₃
• 分子量: 210.617
• InChiKey: UDQNLVNJIZIZCI-UHFFFAOYSA-N

物化性质

• 沸点：
  323.3±21.0 °C(Predicted)
• 密度：
  1.275±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  14
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  43.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  对羟基联苯 、 p-acryloyloxybenzoyl chloride 以 5,5-dimethyl-1,3-cyclohexadiene 为溶剂， 生成 BPCPA
  参考文献：
  名称：

  Experimental and theoretical approaches for structural and mechanical properties of novel side chain LCP-PP graft coproducts

  摘要：

  单体对二苯氧羰基苯甲酸丙烯酸酯（BPCPA）和对二苯氧羰基苯甲基丙烯酸酯（BPCPMA）分别通过对氢氧基二苯基和对丙烯酰氧基苯甲酰氯、对甲基丙烯酰氧基苯甲酰氯进行反应合成，并使用双偶氮化氧化剂在真空条件下进行聚合。单体在聚丙烯上的接枝共聚反应通过在170°C下的批量熔融聚合，使用不同浓度的单体和引发剂进行。反应体系中单体与引发剂的比例提高，接枝共聚物中单体的含量也随之增加。接枝共聚物通过多种实验技术进行表征，包括差示扫描量热法、热重分析、傅里叶变换红外光谱、扫描电子显微镜和力学测试。此外，基于密度泛函理论（B3LYP）和标准6-311++G(d,p)理论级别进行了理论计算，以研究聚丙烯产品机械性能的关键变化。根据获得的结果，由于由聚合物单体的接枝造成速率依赖的粘弹性变形或屈服的损伤，接枝共聚物的机械性能显著降低，从而导致表面能值的增加。同时，实验结果证实，聚（BPCPA）材料的次级范德华键显著弱于聚（BPCPMA）产品中的相应键。

  DOI：

  10.3906/kim-1506-37
• 作为产物：
  描述：

  对羟基苯甲酸 在 氯化亚砜 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 p-acryloyloxybenzoyl chloride
  参考文献：
  名称：

  Experimental and theoretical approaches for structural and mechanical properties of novel side chain LCP-PP graft coproducts

  摘要：

  单体对二苯氧羰基苯甲酸丙烯酸酯（BPCPA）和对二苯氧羰基苯甲基丙烯酸酯（BPCPMA）分别通过对氢氧基二苯基和对丙烯酰氧基苯甲酰氯、对甲基丙烯酰氧基苯甲酰氯进行反应合成，并使用双偶氮化氧化剂在真空条件下进行聚合。单体在聚丙烯上的接枝共聚反应通过在170°C下的批量熔融聚合，使用不同浓度的单体和引发剂进行。反应体系中单体与引发剂的比例提高，接枝共聚物中单体的含量也随之增加。接枝共聚物通过多种实验技术进行表征，包括差示扫描量热法、热重分析、傅里叶变换红外光谱、扫描电子显微镜和力学测试。此外，基于密度泛函理论（B3LYP）和标准6-311++G(d,p)理论级别进行了理论计算，以研究聚丙烯产品机械性能的关键变化。根据获得的结果，由于由聚合物单体的接枝造成速率依赖的粘弹性变形或屈服的损伤，接枝共聚物的机械性能显著降低，从而导致表面能值的增加。同时，实验结果证实，聚（BPCPA）材料的次级范德华键显著弱于聚（BPCPMA）产品中的相应键。

  DOI：

  10.3906/kim-1506-37

文献信息

• [EN] CHIRAL DOPANT AND IDENTIFICATION AND AUTHENTICATION USING POLYMERIC LIQUID CRYSTAL MATERIAL MARKINGS<br/>[FR] DOPANT CHIRAL, ET IDENTIFICATION ET AUTHENTIFICATION FAISANT APPEL À DES MARQUAGES AVEC UN MATÉRIAU POLYMÈRE À CRISTAUX LIQUIDES
  申请人：SICPA HOLDING SA

  公开号：WO2015059076A1

  公开（公告）日：2015-04-30

  Disclosed are chiral dopants of general formula (I) below as well as uses thereof involving chiral liquid crystal polymers and markings comprising these polymers: wherein R1, R2, R3, R4, A1 and A2, m, n, o and p are as defined in the claims.

  本发明涉及一般式（I）的手性掺杂剂以及它们在手性液晶聚合物和包含这些聚合物的标记中的用途：其中R1、R2、R3、R4、A1和A2、m、n、o和p如权利要求所定义。
• CHIRAL DOPANT AND IDENTIFICATION AND AUTHENTICATION USING POLYMERIC LIQUID CRYSTAL MATERIAL MARKINGS
  申请人：SICPA HOLDING SA

  公开号：US20160264591A1

  公开（公告）日：2016-09-15

  Disclosed are chiral dopants of general formula (I) below as well as uses thereof involving chiral liquid crystal polymers and markings comprising these polymers: wherein R 1 , R 2 , R 3 , R 4 , A 1 and A 2 , m, n, o and p are as defined in the claims.

  本发明公开了一种手性掺杂剂，其一般式如下（I），以及涉及手性液晶聚合物和包含这些聚合物的标记的使用方法：其中R1、R2、R3、R4、A1和A2、m、n、o和p如权利要求所定义。
• Thermostabile Pigmente, Filme und Effektbeschichtungen sowie Mischungen zu deren Herstellung
  申请人：Consortium für elektrochemische Industrie GmbH

  公开号：EP1046692A1

  公开（公告）日：2000-10-25

  Mischung aus vernetzbaren flüssigkristallinen Substanzen mit chiraler Phase (LC-Mischung), enthaltend polymerisierbare Gruppen, wobei mindestens 90% der polymerisierbaren Gruppen Bestandteil von Molekülen mit mindestens zwei polymerisierbaren Gruppen (Vernetzermolekülen) sind, dadurch gekennzeichnet, daß 3,2 bis 15 mmol polymerisierbare Gruppen/g LC-Mischung vorhanden sind.

  一种含有可聚合基团的手性相可交联液晶物质混合物（液晶混合物），其中至少 90% 的可聚合基团是由至少含有两个可聚合基团的分子（交联剂分子）组成，其特征在于可聚合基团的含量为 3.2 至 15 毫摩尔/克液晶混合物。
• Synthesis and characterization of p-benzophenoneoxycarbonylphenyl acrylate by means of experimental measurements and theoretical approaches, and bulk melt polymerization
  作者：U. Soykan、S. Cetin、B. Ozturk、F. Karaboga、Y. Zalaoglu、M. Dogruer、G. Yildirim、C. Terzioglu

  DOI：10.1016/j.molstruc.2013.07.003

  日期：2013.10

  This multidisciplinary study deals with not only the synthesis of p-benzophenoneoxycarbonylphenyl acrylate (BPOCPA) in the xylene solvent and production of Poly(BPOCPA) by bulk melt polymerization and solution methods but also the characterization of BPOCPA experimentally (by DCS, UV, IR, H-1 NMR and PL) and theoretically (with DFT method, B3LYP) method for the first time. The FTIR and H-1 NMR measurement results verify that the synthesis of the BPOCPA is performed in the yield of 57 wt% without any impurities. Moreover, DSC melting point belonging to the monomer is found to be about 131.1 degrees C when the C and H contents are noted to be 71.397% and 3.554%, respectively. As for the UV-vis spectrometer findings, the absorption wavelength lambda(max) is observed at 344 nm due to the effective pi-pi* conjugated segments in the title compound. The optical band gap energy is observed to be about 3.22 eV, confirming the presence of the strong electronic donating groups in the monomer. Furthermore, PL spectrum shows that the compound exhibits strong fluorescence centered at 464.4 nm with a large Stokes shift of 120.4 nm. Moreover, the theoretical calculation results indicate that the structure is quite stable but obtains high electronic donor ability for the electrophilic attack (intermolecular interactions), favored by the experimental findings of UV-vis and PL measurements. Theoretical electronic absorption spectra values are also discussed clearly. (c) 2013 Elsevier B.V. All rights reserved.
• A detailed survey for determination of the grafted semifluorinated acrylic compound effect on thermal, microstructural, free volume, mechanical and morphological features of HDPE
  作者：Ugur Soykan、Behiye Ozturk Sen、Sedat Cetin、Ugur Yahsi、Cumali Tav

  DOI：10.1016/j.jfluchem.2020.109511

  日期：2020.5

  This study mainly aims to investigate the role of grafted semifluorinated acrylic compound in the crucial characteristic properties of high density polyethylene (HDPE). Graft copolymerization of the semifluorinated acrylic compound, 3,3,4,4,5,5,6,6,7,7,8,8,8-dodecafluoro-5-methyloctyl-4-(acryloyloxy) benzoate (ABCF13) onto HDPE within the different content levels of ABCF13 (5, 10, 15, 20, 30 and 40 %) was performed by bulk-melt polymerization method. The changes in the thermal, microstructural and free volume characteristics of graft coproducts with extent of grafting were investigated in detail by means of DSC, powder X-ray diffraction and PALS techniques, respectively. The experimental findings showed that the melting temperature of crystalline domains and crystallinity ofHDPE reached the maxima at the 15 % and 40 % ABCF13 contents, respectively. The grafting of ABCF13 onto HDPE also gave rise to significant expansion and contraction in lateral dimensions of orthorhombic unit cell parameters in the crystalline domains of HDPE. Moreover, PALS analyses depicted that the size of the free volumes increased almost linearly with the grafting percentage. As for mechanical behaviours of the graft products, remarkable improvements were achieved in especially tensile strength (from 18.75 MPa to 43.75 MPa) and impact strength (from 19.30 Mpa to 38.72 MPa). The morphological properties of the fractured surfaces obtained from tensile and impact tests of products were also examined by SEM analysis. The samples possessed completely homogeneous structure without any phase separation. A gradual transition from ductile behaviour to brittle nature was observed as the grafting level increased in the products.