CAS: 83883-26-5; 4-((6-(Acryloyloxy)Hexyl)Oxy)Benzoic Acid

• 英文名称4-((6-(Acryloyloxy)Hexyl)Oxy)Benzoic Acid
• 中文名称4-(6-丙-2-烯氧基氧基己氧基)苯甲酸
• IUPAC名称4-((6-(acryloyloxy)hexyl)oxy)benzoic acid
• 其它别名4-(6-(丙烯酰氧基)己氧基)苯; 4-(6-Acryloyloxyhexyloxy) Benzoic Acid
• CAS编号83883-26-5
• MFCD编号:MFCD01166387
• EINECS号:963-947-7
• 分子式:C16H20O5
• 分子量:292.33
• 产品CID: 1827168
• 产品分类有机原料→分子砌块→芳环类化合物→苯类化合物

• 相似结构搜索
• InChIKey: FLPSQLAEXYKMGQ-UHFFFAOYSA-N
• InChI=1S/C16H20O5/c1-2-15(17)21-12-6-4-3-5-11-20-14-9-7-13(8-10-14)16(18)19/h2,7-10H,1,3-6,11-12H2,(H,18,19)…
• 计算化学: 氢键受体数4.0氢键供体数1.0可旋转键数10.0

物理性质

• 熔点92-93 °C
• 沸点446.9°C at 760 mmHg
• 闪点160.4 °C
• 密度1.139 g/cm3
• pKa:4.48±0.10(预测)
• PSA:72.83
• LogP:3.0532
• 外观形态白色粉末
• 储存条件2-8°C
• 产品应用该化合物用作制药合成的中间体.

MSDS等安全信息

• GHS象形图
• GHS符号GHS07;
  注释: Exclamation mark
• 危险类别皮肤腐蚀/刺激 类别2
  严重眼刺激 类别2
• 警示词Warning(警告)
• 危险描述H315 |造成皮肤刺激.
  H319 |造成严重眼刺激.
• 防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

欧盟法规

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合成工艺路线路线简述

• 合成目标产物 4-((6-(Acryloyloxy)Hexyl)Oxy)Benzoic Acid 主要起始原料 4-(6-Hydroxyhexyloxy)Benzoic Acid And Acryloyl Chloride
• 123978-95-0 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide Solvents: Water; 5 H,Reflux2.1 Reagents: N,N-Dimethylaniline Solvents: 1,4-Dioxane; 60 °C; 2 H,60 °C
  标题:Fabrication Of Highly Efficient Coatable Polarizer From Tolane-Based Smectic Reactive Mesogen
  作者:He,Rui; Et Al
  参考文献:Polymer 日期:2019 卷标:176 页码:51-59]
  
  2009-83-8 + 15872-41-0 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide Catalysts: Potassium Iodide Solvents: Ethanol,Water; 45 Min,Heated; 20 H,Reflux1.2 Reagents: Hydrochloric Acid Solvents: Water; Acidified2.1 Reagents: P-Toluenesulfonic Acid,Hydroquinone Solvents: Chloroform; Reflux
  标题:Hydrogen Bonding And Liquid Crystallinity Of Low Molar Mass And Polymeric Mesogens Containing Benzoic Acids: A Variable Temperature Fourier Transform Infrared Spectroscopic Study
  作者:Martinez-Felipe,A.; Et Al
  参考文献:Phase Transitions 日期:2014 卷标:87(12) 页码:1191-1210]
  
  2009-83-8 + 99-76-3 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide Solvents: Methanol; 30 Min,Reflux1.2 Catalysts: Potassium Iodide; Reflux; 4 H,Reflux1.3 Reagents: Sodium Hydroxide Solvents: Methanol,Water; 8 H,Reflux1.4 Reagents: Hydrochloric Acid Solvents: Water; Ph 12.1 Catalysts: P-Toluenesulfonic Acid,Hydroquinone Solvents: Chloroform; 6 H,100 °C
  标题:Synthesis And Photoinduced Reorientation Of Liquid Crystalline Polymers With Phenyl Thiobenzoate Side Groups
  作者:Kawatsuki,Nobuhiro; Et Al
  参考文献:Macromolecules (Washington 日期:2013 卷标:46(6) 页码:2092-2099]
  
  2009-83-8 + 99-96-7 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide,Potassium Iodide Solvents: Ethanol,Water; 20 Min,Rt; 16 H,90 °C2.1 Reagents: N,N-Dimethylaniline Solvents: 1,4-Dioxane; Rt; 0.5 H,Rt; Rt -> 55 °C; 3 H,55 °C
  标题:Tough And Photo-Plastic Liquid Crystal Elastomer With A 2-Fold Dynamic Linker For Artificial Muscles
  作者:Wu,Yongpeng; Et Al
  参考文献:Acs Applied Materials & Interfaces 日期:2023 卷标:15(37) 页码:44205-44211]
  
  4286-55-9 + 99-96-7 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide Solvents: Ethanol,Water; 15 H,Reflux1.2 Reagents: Hydrochloric Acid Solvents: Water; Ph 2 - 32.1 Solvents: Dimethylacetamide; 15 - 20 °C; 2 H,Rt2.2 Solvents: Water; 0 °C
  标题:Programmable Chromism And Photoluminescence Of Spiropyran-Based Liquid Crystalline Polymer With Tunable Glass Transition Temperature
  作者:Hu,Wei; Et Al
  参考文献:Angewandte Chemie 日期:2021 卷标:60(35) 页码:19406-19412]
  
  4286-55-9 + 99-96-7 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide Solvents: Ethanol,Water; 36 H,Reflux; Reflux -> Rt1.2 Reagents: Hydrochloric Acid Solvents: Water; Ph 3 - 4,Rt2.1 Reagents: N,N-Dimethylaniline Solvents: Tetrahydrofuran; 30 Min,Cooled; 48 H,Rt2.2 Reagents: Hydrochloric Acid Solvents: Water; Ph 3 - 4,Cooled
  标题:Allyl Sulfide-Based Visible Light-Induced Dynamically Reshaped Liquid Crystalline Elastomer/swcnt Nanocomposites Capable Of Multimode Nir Photomechanical Actuations
  作者:Wu,Zhongying; Et Al
  参考文献:New Journal Of Chemistry 日期:2020 卷标:44(26) 页码:10902-10910]
  
  98033-73-9 = 83883-26-5
  反应条件:1.1 Reagents: Sodium Iodide Solvents: Acetone; 5 H,Reflux2.1 Solvents: Dimethylformamide; 1.5 H,80 °C; 15 H,Rt
  标题:The Smectogenity As A Crucial Factor Of Broadening Of The Selective Light Reflection Peak In Cholesteric Photopolymerizable Mixtures
  作者:Muraveva,Valeriia; Et Al
  参考文献:Liquid Crystals 日期:2022 卷标:49(11) 页码:1459-1465]
  
  4286-55-9 + 123-08-0 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Carbonate Solvents: Dimethylformamide; Overnight,60 °C2.1 Reagents: Triethylamine Solvents: Dichloromethane; 5 Min,0 °C2.2 10 Min,0 °C; 0 °C -> Rt; Overnight,Rt3.1 Reagents: Monosodium Phosphate,Sodium Chlorite Solvents: Dimethyl Sulfoxide,Water
  标题:Polar Liquid Crystalline Polymers Bearing Mesogenic Side Chains With Large Dipole Moment
  作者:Dai,Shuqi; Et Al
  参考文献:Macromolecules (Washington 日期:2021 卷标:54(13) 页码:6045-6051]
  
  4286-55-9 + 99-76-3 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: Potassium Iodide Solvents: Dimethylformamide; 12 H,80 °C2.1 Reagents: Sodium Hydroxide Solvents: Methanol; 6 H,Reflux3.1 Reagents: N,N-Dimethylaniline Solvents: 1,4-Dioxane; 3 H,60 °C
  标题:Coupling Of Photoinduced Mass Immigration With Polymer Networks To Produce Nanostructured Materials Capable Of Reversibly Creating Arbitrary Deformations
  作者:Yin,Xianpeng; Et Al
  参考文献:Macromolecular Chemistry And Physics 日期:2018 卷标:219(14)]
  
  4286-55-9 + 99-76-3 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Carbonate,Potassium Iodide Solvents: Acetone; 24 H,Reflux2.1 Reagents: Potassium Hydroxide Solvents: Ethanol,Water; Rt; Overnight,Rt -> Reflux2.2 Reagents: Hydrochloric Acid Solvents: Water; Acidified3.1 Reagents: Dimethylacetamide Solvents: 1,4-Dioxane; 15 Min,0 °C; 0 °C -> Rt; Overnight,45 °C3.2 Solvents: Water; Cooled
  标题:The First Blue Phase Reactive Monomers Containing A Bi-Mesogenic Core And Their Side-Chain Polymers
  作者:Wei,Chong-Lun; Et Al
  参考文献:Journal Of Materials Chemistry C: Materials For Optical And Electronic Devices 日期:2015 卷标:3(18) 页码:4663-4669]
  
  83883-25-4 + 814-68-6 = 83883-26-5
  反应条件:1.1 Solvents: N-Methyl-2-Pyrrolidone; 3 H,Rt
  标题:Opposite Self-Folding Behavior Of Polymeric Photoresponsive Actuators Enabled By A Molecular Approach
  作者:Martella,Daniele; Et Al
  参考文献:Polymers (Basel 日期:2019 卷标:11(10)]
  
  140918-55-4 = 83883-26-5
  反应条件:1.1 Reagents: Monosodium Phosphate,Sodium Chlorite Solvents: Dimethyl Sulfoxide,Water
  标题:Polar Liquid Crystalline Polymers Bearing Mesogenic Side Chains With Large Dipole Moment
  作者:Dai,Shuqi; Et Al
  参考文献:Macromolecules (Washington 日期:2021 卷标:54(13) 页码:6045-6051]
  
  2009-83-8 + 99-96-7 + 814-68-6 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide,Potassium Iodide Solvents: Ethanol,Water; Rt; 10 Min,Reflux1.2 2 H,Reflux1.3 Reagents: N,N-Dimethylaniline,2,6-Di-Tert-Butyl-4-Methylphenol Solvents: 1,4-Dioxane; Cooled; 24 H,Rt
  标题:Optical Properties Of Chiral Nematic Side-Chain Copolymers Bearing Cholesteryl And Azobenzene Building Blocks
  作者:Liu,Jui-Hsiang; Et Al
  参考文献:Journal Of Polymer Science 日期:2011 卷标:49(3) 页码:770-780]
  
  7446-81-3 = 83883-26-5
  反应条件:1.1 Solvents: Dimethylformamide; 1.5 H,80 °C; 15 H,Rt
  标题:The Smectogenity As A Crucial Factor Of Broadening Of The Selective Light Reflection Peak In Cholesteric Photopolymerizable Mixtures
  作者:Muraveva,Valeriia; Et Al
  参考文献:Liquid Crystals 日期:2022 卷标:49(11) 页码:1459-1465]
  
  123978-95-0 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide Solvents: Water; 100 °C2.1 Reagents: N,N-Dimethylaniline Solvents: 1,4-Dioxane; 60 °C
  标题:Bulk-Mediated In-Situ Homogeneous Photoalignment Induced By Reactive Mesogen Containing Diphenylacetylene Moiety
  作者:He,Rui; Et Al
  参考文献:Liquid Crystals 日期:2020 卷标:47(6) 页码:819-830]
  
  2009-83-8 + 99-96-7 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide,Potassium Iodide Solvents: Ethanol,Water; 18 H,Reflux2.1 Solvents: N-Methyl-2-Pyrrolidone; 3 H,Rt
  标题:The Role Of Crosslinker Molecular Structure On Mechanical And Light-Actuation Properties In Liquid Crystalline Networks
  作者:Donato,Simone; Et Al
  参考文献:Macromolecular Rapid Communications 日期:2023 卷标:44(9)]
  
  2009-83-8 + 99-96-7 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide,Potassium Iodide Solvents: Ethanol,Water; 20 Min,Rt; 16 H,Rt -> 90 °C2.1 Reagents: N,N-Dimethylaniline Solvents: 1,4-Dioxane; < 10 Min,0 °C; 0 °C -> Rt; 0.5 H,Rt; 3 H,55 °C
  标题:Ultrahigh Fatigue Resistant Liquid Crystal Elastomer-Based Material Enabled By Liquid Metal
  作者:Lu,Hai-Feng; Et Al
  参考文献:Science China Materials 日期:2022 卷标:65(6) 页码:1679-1686]
  
  395071-32-6 = 83883-26-5
  反应条件:1.1 Reagents: Sodium Hydroxide Solvents: Methanol; 6 H,Reflux2.1 Reagents: N,N-Dimethylaniline Solvents: 1,4-Dioxane; 3 H,60 °C
  标题:Coupling Of Photoinduced Mass Immigration With Polymer Networks To Produce Nanostructured Materials Capable Of Reversibly Creating Arbitrary Deformations
  作者:Yin,Xianpeng; Et Al
  参考文献:Macromolecular Chemistry And Physics 日期:2018 卷标:219(14)]
  
  395071-32-6 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide Solvents: Ethanol,Water; Rt; Overnight,Rt -> Reflux1.2 Reagents: Hydrochloric Acid Solvents: Water; Acidified2.1 Reagents: Dimethylacetamide Solvents: 1,4-Dioxane; 15 Min,0 °C; 0 °C -> Rt; Overnight,45 °C2.2 Solvents: Water; Cooled
  标题:The First Blue Phase Reactive Monomers Containing A Bi-Mesogenic Core And Their Side-Chain Polymers
  作者:Wei,Chong-Lun; Et Al
  参考文献:Journal Of Materials Chemistry C: Materials For Optical And Electronic Devices 日期:2015 卷标:3(18) 页码:4663-4669]
  
  4286-55-9 + 99-96-7 = 83883-26-5
  反应条件:1.1 Reagents: Potassium Hydroxide Solvents: Ethanol2.1 -
  标题:Humidity-Responsive Blue Phase Liquid-Crystalline Film With Reconfigurable And Tailored Visual Signals
  作者:Hu,Wei; Et Al
  参考文献:Advanced Functional Materials 日期:2020 卷标:30(43)]
  
  96735-91-0 + 814-68-6 = 83883-26-5
  反应条件:1.1 Reagents: Triethylamine Solvents: Dichloromethane; 5 Min,0 °C1.2 10 Min,0 °C; 0 °C -> Rt; Overnight,Rt2.1 Reagents: Monosodium Phosphate,Sodium Chlorite Solvents: Dimethyl Sulfoxide,Water
  标题:Polar Liquid Crystalline Polymers Bearing Mesogenic Side Chains With Large Dipole Moment
  作者:Dai,Shuqi; Et Al
  参考文献:Macromolecules (Washington 日期:2021 卷标:54(13) 页码:6045-6051]
  
  83883-25-4 + 814-68-6 = 83883-26-5
  反应条件:1.1 Reagents: Dimethylacetamide Solvents: 1,4-Dioxane; 15 Min,0 °C; 0 °C -> Rt; Overnight,45 °C1.2 Solvents: Water; Cooled
  标题:The First Blue Phase Reactive Monomers Containing A Bi-Mesogenic Core And Their Side-Chain Polymers
  作者:Wei,Chong-Lun; Et Al
  参考文献:Journal Of Materials Chemistry C: Materials For Optical And Electronic Devices 日期:2015 卷标:3(18) 页码:4663-4669]
  
  83883-25-4 + 814-68-6 = 83883-26-5
  反应条件:1.1 Solvents: Dimethylacetamide; 15 - 20 °C; 2 H,Rt1.2 Solvents: Water; 0 °C
  标题:Programmable Chromism And Photoluminescence Of Spiropyran-Based Liquid Crystalline Polymer With Tunable Glass Transition Temperature
  作者:Hu,Wei; Et Al
  参考文献:Angewandte Chemie 日期:2021 卷标:60(35) 页码:19406-19412

海关参考信息

• 2901210000-乙烯
  2901220000-丙烯
  2905121000-正丙醇
  2905130000-正丁醇
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