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3,4-di(octadecyloxy)acetophenone | 1198054-82-8

中文名称
——
中文别名
——
英文名称
3,4-di(octadecyloxy)acetophenone
英文别名
1-(3,4-Dioctadecoxyphenyl)ethanone
3,4-di(octadecyloxy)acetophenone化学式
CAS
1198054-82-8
化学式
C44H80O3
mdl
——
分子量
657.117
InChiKey
JUSIUZKPRHPGNM-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    19.2
  • 重原子数:
    47
  • 可旋转键数:
    37
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.84
  • 拓扑面积:
    35.5
  • 氢给体数:
    0
  • 氢受体数:
    3

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    3,4-di(octadecyloxy)acetophenone4-二甲氨基吡啶N,N'-二环己基碳二亚胺 、 potassium hydroxide 作用下, 以 乙醇二氯甲烷 为溶剂, 生成
    参考文献:
    名称:
    Synthesis and mesomorphic properties of new chalconyl-ester based liquid crystals: The effect of tail group
    摘要:
    A new homologous series viz. 4-(3-(3, 4-dioctadecyloxy) phenyl)-3-oxoprop-1-en-1-yl) phenyl-3-(4-n-alkoxy phenyl) cinnamate) based on two linking groups have been synthesized and characterized. The mesomorphic properties of these compounds were observed by optical polarized light microscopy (POM) and confirmed by differential scanning calorimetry (DSC). All synthesized compounds exhibited LC behaviour except compound C-1. Thermal stability of smectic and nematic phase of present series are 79.0 degrees C and 120.0 degrees C whose temperature range is vary from 14 to 20 degrees C and 24 to 56 degrees C respectively. The mesomorphic properties of present series were compared with other structurally related mesogenic homologous series to evaluate the effects of tail group on mesomorphism.
    DOI:
    10.1080/15421406.2017.1344465
  • 作为产物:
    描述:
    参考文献:
    名称:
    Synthesis and mesomorphic properties of new chalconyl-ester based liquid crystals: The effect of tail group
    摘要:
    A new homologous series viz. 4-(3-(3, 4-dioctadecyloxy) phenyl)-3-oxoprop-1-en-1-yl) phenyl-3-(4-n-alkoxy phenyl) cinnamate) based on two linking groups have been synthesized and characterized. The mesomorphic properties of these compounds were observed by optical polarized light microscopy (POM) and confirmed by differential scanning calorimetry (DSC). All synthesized compounds exhibited LC behaviour except compound C-1. Thermal stability of smectic and nematic phase of present series are 79.0 degrees C and 120.0 degrees C whose temperature range is vary from 14 to 20 degrees C and 24 to 56 degrees C respectively. The mesomorphic properties of present series were compared with other structurally related mesogenic homologous series to evaluate the effects of tail group on mesomorphism.
    DOI:
    10.1080/15421406.2017.1344465
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文献信息

  • Nitrochalcones as organogelators: evidence of the involvement of nitro groups and solvent in gel formation
    作者:François-Xavier Simon、Thi-Thanh-Tam Nguyen、Marc Schmutz、Gero Decher、Jean-François Nicoud、Philippe J. Mésini
    DOI:10.1039/b902444a
    日期:——
    4-alkoxynitrochalcones have been synthesized and shown to be organogelators; dodecyloxy/benzyl alcohol gels have been studied by freeze-fracture electron microscopy, DSC and FTIR. We show that the nitro group is involved in the formation of the gel and that the gelator co-assembles with solvent molecules.
    已经合成了新的4-烷氧基硝基查耳酮,并显示是有机胶凝剂。 十二烷氧基/苯甲醇已经通过冷冻断裂电子显微镜,DSC和FTIR研究了凝胶。我们表明,硝基参与了凝胶的形成,并且胶凝剂与溶剂分子共组装。
  • CHALCONE DERIVATIVE COMPOUNDS
    申请人:NIPPON OIL AND FATS COMPANY, LIMITED
    公开号:EP0328669A1
    公开(公告)日:1989-08-23
    Chalcone derivative compounds represented by general formula (I) or (II), wherein R₁ and R₂ each represents a ha­logen atom, a hydroxy group, an amino group, a dimethylamino group, a nitro group, a cyano group, a phenyl group, an acetyl group, an alkyl group containing 1 to 18 carbon atoms or an alkyloxy group containing 1 to 22 carbon atoms, n₁ and n₂ each represents an integer of 0 to 21, and m₁ and m₂ each represents an integer of 0 to 5.
    通式(I)或(II)代表的查耳酮生物化合物,其中 R₁ 和 R₂ 各自代表卤素原子、羟基、基、二甲基基、硝基、基、苯基、乙酰基、含 1 至 18 个碳原子的烷基或含 1 至 22 个碳原子的烷氧基,n₁ 和 n₂ 各自代表整数、乙酰基、含 1 至 18 个碳原子的烷基或含 1 至 22 个碳原子的烷氧基,n₁ 和 n₂ 各自代表 0 至 21 的整数,m₁ 和 m₂ 各自代表 0 至 5 的整数。
  • Synthesis and properties of new calamitic-shaped liquid crystal compounds with disubstituted octadecyloxy (‒OC<sub>18</sub>H<sub>37</sub>) tail groups
    作者:Vinay S. Sharma、Anuj S. Sharma、R. B. Patel
    DOI:10.1080/15421406.2017.1412581
    日期:2017.11.22
    In present study, we have synthesized such newly chalcone-ester linking group based homologous series containing disubstituted octadecyloxy tail part. A series of new chalcones with having three aromatic rings is synthesized and characterised by elemental analyses and spectroscopic techniques such as Fourier transform infrared [FT-IR] and proton magnetic resonance magnetic resonance [H-1 NMR] spectroscopy. The mesomorphic properties of these compounds were observed by optical polarized light microscopy (POM) and confirmed by differential scanning calorimetry (DSC). It is found that all the prepared materials display enantiotropic LCs phases except first three homologue in present series. Comp. C-1 to C-12 exhibits only enantiotropic nematic phase. However, in higher member comp.C-14 to C-18 shows enantiotropic SmC and nematic phase. Thermal stability of smectic and nematic phase of present series is found to be 51.33 degrees C and 109.0 degrees C.[GRAPHICS]
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