CAS: 928-90-5; 5-Hexyn-1-Ol

• 英文名称5-Hexyn-1-Ol
• 中文名称己-5-炔-1-醇
• IUPAC名称hex-5-yn-1-ol
• 其它别名5-己炔-1-醇; 5-Hexyn-1-Ol
• CAS编号928-90-5
• MFCD编号:MFCD00002980
• EINECS号:618-884-7
• 分子式:C6H10O
• 分子量:98.14
• 产品CID: 1967658
• 产品分类有机原料→分子砌块→脂肪链类化合物

• 相似结构搜索
• 产品信息参考;;
• InChIKey: GOQJMMHTSOQIEI-UHFFFAOYSA-N
• InChI=1S/C6H10O/c1-2-3-4-5-6-7/h1,7H,3-6H2…
• 计算化学: 氢键受体数1.0氢键供体数1.0可旋转键数3.0

相似化合物

物理性质

• 熔点-34 °C
• 沸点167.1°C at 760 mmHg
• 闪点70°C
• 密度0.9±0.1 g/cm3
• pKa:15.05±0.10(预测)
• PSA:20.23
• LogP:0.7822
• 折射率1.449
• 蒸汽压0.6±0.6 mmHg at 25°C
• 溶解性Slightly Miscible With Water.
• 敏感性常温常压下稳定，避免强氧化剂 酸性氯化物 酸酐接触
• 外观形态无色至淡黄色液体
• 储存条件惰性气氛,2-8°C
• 产品应用该化合物用于合成使用二苯基苯乙烯,二氯苯基烯,氨基氨A和(+)-纳米甲基氨基丁A和 (+)纳米甲库林B和7-苯氧-3-(2-硝基苯基塞利诺)-1-5-环二苯乙烯.

MSDS等安全信息

• GHS象形图
• GHS符号GHS07;
  注释: Exclamation mark
• 危险类别特定目标器官毒性 - 单次接触 类别3
  皮肤腐蚀/刺激 类别2
  严重眼刺激 类别2
  严重眼刺激 类别2A
• 警示词Warning(警告)
• 危险描述H335 |可能引起呼吸道刺激.
  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
• UN编号3272
• 危险品标志Xi
• 包装等级III
• 安全声明26-36
• 危险类别码36/37/38
• WGK Germany3

欧盟法规

上下游产品

合成工艺路线路线简述

• 73448-13-2 = 928-90-5
  反应条件:1.1 Reagents: Hydrochloric Acid Solvents: Methanol,Water; 1 H,23 °C1.2 Reagents: Triethylamine; Neutralized
  标题:Regioselectivity Influences In Platinum-Catalyzed Intramolecular Alkyne O-H And N-H Additions
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  参考文献:Organic Letters 日期:2019 卷标:21(24) 页码:9934-9939]
  
  53293-00-8 = 928-90-5
  反应条件:1.1 Reagents: Lithium Aluminum Hydride Solvents: Diethyl Ether; 0 °C; 0 °C -> Rt; 3 H,Rt; Rt -> 0 °C1.2 Reagents: Sodium Sulfate Solvents: Water; 0 °C
  标题:Synthesis And Biological Activity Of 20-Hete Antagonists And Agonists
  参考文献:World Intellectual Property Organization]
  
  17889-21-3 = 928-90-5
  反应条件:1.1 Reagents: Sulfuric Acid,Water
  标题:Synthesis Of Some Acetylenic Alcohols
  作者:Zakharkin,L. I.; Stanko,V. I.; Brattsev,V. A.
  参考文献:Izvestiya Akademii Nauk Sssr 日期:1964 卷标:(5) 页码:931-2]
  
  764-60-3 = 928-90-5
  反应条件:1.1 Reagents: 1,3-Propanediamine,Lithium; 1 H,70 °C; 70 °C -> Rt1.2 Reagents: Potassium Tert-Butoxide; 20 Min,Rt1.3 10 Min,Rt; 3 H,Rt
  标题:Synthesis Of α,β-Unsaturated Epoxy Ketones Utilizing A Bifunctional Sulfonium/phosphonium Ylide
  作者:Eskandari,Roozbeh; Hess,Jeremy P.; Tochtrop,Gregory P.
  参考文献:Chemical Communications (Cambridge 日期:2021 卷标:57(58) 页码:7136-7139]
  
  764-60-3 = 928-90-5
  反应条件:1.1 Reagents: 1,3-Propanediamine,Lithium; 30 Min,Rt; 3 H,Rt -> 70 °C; 70 °C -> Rt1.2 Reagents: Potassium Tert-Butoxide; Rt; 30 Min,Rt1.3 Rt; 1 H,Rt1.4 Reagents: Water; Cooled
  标题:Method For Synthesis Of Pine Moth Pheromone
  参考文献:China]
  
  90965-06-3 + 4221-03-8 = 928-90-5
  反应条件:1.1 Reagents: Potassium Carbonate Solvents: Methanol; 5.5 H,Rt
  标题:Syntheses And Biological Evaluation Of 1,2,3-Triazole And 1,3,4-Oxadiazole Derivatives Of Imatinib
  作者:Li,Yong-Tao; Wang,Jing-Han; Pan,Cheng-Wen; Meng,Fan-Fei; Chu,Xiao-Qian; Et Al
  参考文献:Bioorganic & Medicinal Chemistry Letters 日期:2016 卷标:26(5) 页码:1419-1427]
  
  53293-00-8 = 928-90-5
  反应条件:1.1 Reagents: Lithium Aluminum Hydride Solvents: Tetrahydrofuran; 0 °C -> Rt; 15 H,Rt
  标题:Phase Separation As A Strategy Toward Controlling Dilution Effects In Macrocyclic Glaser-Hay Couplings
  作者:Bedard,Anne-Catherine; Collins,Shawn K.
  参考文献:Journal Of The American Chemical Society 日期:2011 卷标:133(49) 页码:19976-19981]
  
  18420-41-2 = 928-90-5 [标题:Reaction Conditions
  标题:Enantiospecific Synthesis Of 14S,15S Leukotriene A4 Methyl Ester
  作者:Rao,A. V. Rama; Purandare,A. V.; Singh,A. K.
  参考文献:Bioorganic & Medicinal Chemistry Letters 日期:1991 卷标:1(4) 页码:201-4]
  
  18420-41-2 = 928-90-5
  反应条件:1.1 Reagents: Sodium Catalysts: Iron Nitrate (Fe(No3)3) Nonahydrate Solvents: Ammonia
  标题:Ene-Reactions And Allylsilane Cyclization For High Diastereoselective Construction Of Cyclopentane- And Cyclohexane- Derivatives
  作者:Ruther,Michael
  参考文献:1990]
  
  18420-41-2 = 928-90-5
  反应条件:1.1 Reagents: Butyllithium Solvents: Tetrahydrofuran,Hexane
  标题:Synthesis And Activity Of Boron-Containing Compounds For Selective Tumour Therapy Using Neutron Irradiation
  作者:Griesbach,Ulrich
  参考文献:2002]
  
  18420-41-2 = 928-90-5
  反应条件:1.1 Reagents: Lithium,Ammonia Catalysts: Ferric Nitrate; 5 H,-25 °C1.2 Reagents: Ammonium Chloride Solvents: 2-Methyltetrahydrofuran,Water; -25 °C -> 35 °C1.3 Reagents: Chloroacetic Acid; Ph 9.5
  标题:A Process For Preparing Chlorinated Alkynes From Epoxy Alcohols
  参考文献:China]
  
  1720-37-2 = 928-90-5
  反应条件:1.1 Catalysts: Ammonium Nitrate
  标题:Microwave Thermolysis. V. A Rapid And Selective Method For The Cleavage Of Thp Ethers,Acetals And Acetonides Using Clay Supported Ammonium Nitrate "Clayan" In Dry Media
  作者:Meshram,H. M.; Sumithra,G.; Reddy,G. S.; Ganesh,Y. S. S.; Yadav,J. S.
  参考文献:Synthetic Communications 日期:1999 卷标:29(16) 页码:2807-2815]
  
  18420-41-2 = 928-90-5
  反应条件:1.1 Reagents: Ammonia,Sodium Amide Catalysts: Ferric Nitrate1.2 Reagents: Ammonium Chloride
  标题:Efficient Synthesis Of 8,11-Dimethylene-Bicyclo[5.3.1]Undecan-2-One
  作者:Gu,Haining; Xu,Wei Ming; Kinstle,Thomas H.
  参考文献:Tetrahedron Letters 日期:2005 卷标:46(38) 页码:6449-6451]
  
  764-60-3 = 928-90-5
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  标题:Synthesis Of Exo-Brevicomins,The Aggregation Pheromone Of Bark Beetle
  作者:Zhu,Jin; Wang,Shumei; Feng,Liugui; Teng,Youwei
  参考文献:Hecheng Huaxue 日期:1993 卷标:1(1) 页码:35-8]
  
  108207-99-4 = 928-90-5
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  标题:Synthesis And Reactivity Of ω-Functionalized Propargylic Silanes. Preparation Of 3-Vinylideneoxolanes,-Oxanes,-Oxepanes,And -Oxocanes
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  53293-00-8 = 928-90-5
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  参考文献:Green Chemistry 日期:2023 卷标:25(7) 页码:2663-2671]
  
  123186-35-6 = 928-90-5
  反应条件:1.1 Reagents: Phosphorus Oxychloride Solvents: 1,2-Dichloroethane; 50 Min,Rt1.2 Reagents: Water; Cooled
  标题:A Convenient Approach For The Deprotection And Scavenging Of The Pmb Group Using Pocl3
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  18420-41-2 = 928-90-5
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  参考文献:1996]
  
  18420-41-2 = 928-90-5
  反应条件:1.1 Reagents: Sodium Amide; 1 H,-40 °C; 3 H,-40 °C1.2 Solvents: Water; Rt
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  作者:Kikuchi,Kohei; Tatewaki,Yoko; Okada,Shuji
  参考文献:Bulletin Of The Chemical Society Of Japan 日期:2017 卷标:90(3) 页码:298-305]
  
  764-60-3 = 928-90-5
  反应条件:1.1 Reagents: Lithium Solvents: Ethylenediamine; 1.5 H,80 °C; 80 °C -> Rt1.2 Reagents: Potassium Tert-Butoxide; 30 Min,Rt1.3 Rt; 2 H,Rt1.4 Reagents: Sodium Bicarbonate Solvents: Water; Rt
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  参考文献:Organic Chemistry Frontiers 日期:2017 卷标:4(6) 页码:951-957

海关参考信息

• 2901292000-乙炔
  2905121000-正丙醇
  2905130000-正丁醇
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