CAS: 885-82-5; 3-Nitro-[1,1'-Biphenyl]-4-Ol

• 英文名称3-Nitro-[1,1'-Biphenyl]-4-Ol
• 中文名称3-硝基-[1,1'-联苯]-4-醇
• IUPAC名称2-nitro-4-phenylphenol
• 其它别名4-羟基-3-硝基联苯; 4-Hydroxy-3-Nitrobiphenyl
• CAS编号885-82-5
• MFCD编号:MFCD00014694
• EINECS号:212-946-3
• FDA UNII编号:ARF4GZ3MF3
• 分子式:C12H9NO3分子量:215.21
• 产品CID: 1900114
• 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
• 产品信息参考;;
• InChIKey: JDDNJJBXFOLPKX-UHFFFAOYSA-N
• InChI=1S/C12H9NO3/c14-12-7-6-10(8-11(12)13(15)16)9-4-2-1-3-5-9/h1-8,14H
• 计算化学: 氢键受体数3.0氢键供体数1.0可旋转键数2.0

物理性质

• 熔点69-70 °C
• 沸点338.5±30.0 °C at 760 mmHg
• 闪点145.1±13.0 °C
• 密度1.3±0.1 g/cm3
• pKa:6.97±0.14(预测)
• PSA:63.37
• LogP:2.9674
• 折射率1.638
• 蒸汽压0.0±0.8 mmHg at 25°C
• 溶解性Insoluble In Water
• 敏感性常温常压下稳定，避免氧化物接触
• 外观形态淡黄色至棕色粉末至晶体
• 储存条件保持容器密封保存，储存在阴凉，干燥环境的地方

MSDS等安全信息

• GHS象形图
• GHS符号GHS07 & GHS05;
  注释: Exclamation mark & Corrosion
• 危险类别急性毒性 类别4(经口)
  特定目标器官毒性 - 单次接触 类别3
  皮肤腐蚀/刺激 类别2
  严重眼损伤 类别1
  严重眼刺激 类别2
• 警示词Danger(危险)
• 危险描述H302 |吞咽有害.
  H335 |可能引起呼吸道刺激.
  H315 |造成皮肤刺激.
  H318 |造成严重眼损伤.
  H319 |造成严重眼刺激.
• 防范说明P264-P280-P302+P352-P362+P364
• 危险等级IRRITANT
• 安全声明26-36
• 危险类别码36/37/38

欧盟法规

上下游产品

合成工艺路线路线简述

• 合成目标产物 4-Hydroxy-3-Nitrobiphenyl 主要起始原料 Pyridine, 2-([1,1'-Biphenyl]-4-Yloxy)-
• 92-69-3 = 885-82-5
  反应条件:1.1 Reagents: Citric Acid,Sodium Nitrite,Water Solvents: Hexane; 180 Min,Rt
  标题:1,3-Dihalo-5,5-Dimethylhydantoin Or Citric Acid/nano2 As A Heterogeneous System For The Selective Mononitration Of Phenols Under Mild Conditions
  作者:Zolfigol,Mohammad A.; Ghaemi,Ezat; Madrakian,Elaheh; Choghamarani,Arash G.
  参考文献:Mendeleev Communications 日期:2006 卷标:(1) 页码:41-42]
  
  92-69-3 = 885-82-5
  反应条件:1.1 Catalysts: Tetrabutylammonium Nitrite,Bromodimethylsulfonium Bromide Solvents: Acetonitrile; 1.5 H,Rt1.2 Reagents: Sodium Bicarbonate Solvents: Water; Rt
  标题:Bromodimethylsulfonium Bromide/tetrabutylammonium Nitrite,An Efficient Catalyst Mixture For The Nitration Of Phenols
  作者:Akhlaghinia,Batool; Pourali,Alireza
  参考文献:Turkish Journal Of Chemistry 日期:2010 卷标:34(5) 页码:753-759]
  
  92-69-3 = 885-82-5
  反应条件:1.1 Reagents: Bismuth Nitrate Solvents: Acetone; 2 H,20 °C1.2 Reagents: Sodium Bicarbonate
  标题:Improved Protocol For Mononitration Of Phenols With Bismuth(Iii) And Iron(Iii) Nitrates
  作者:Wasinska,Malgorzata; Korczewska,Anna; Giurg,Miroslaw; Skarzewski,Jacek
  参考文献:Synthetic Communications 日期:2015 卷标:45(1) 页码:143-150]
  
  92-69-3 = 885-82-5
  反应条件:1.1 Reagents: Silica,Sodium Nitrate,Sodium Bisulfate Solvents: Dichloromethane
  标题:Nitration Of Phenols Under Mild And Heterogeneous Conditions
  作者:Zolfigol,Mohammad Ali; Ghaemi,Ezat; Madrakian,Elahe
  参考文献:Molecules [online Computer File] 日期:2001 卷标:6(7) 页码:614-620]
  
  92-69-3 = 885-82-5
  反应条件:1.1 Reagents: Silica (Chlorinated),Sodium Nitrite,Water Solvents: Dichloromethane; 30 Min,Rt
  标题:Silica Chloride/nano2 As A Novel Heterogeneous System For The Nitration Of Phenols Under Mild Conditions
  作者:Zolfigol,Mohammad Ali; Shirini,Farhad; Chogamarani,Arash Ghorbani
  参考文献:Phosphorus 日期:2003 卷标:178(9) 页码:2019-2025]
  
  98-80-6 + 7693-52-9 = 885-82-5
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: Palladium Diacetate,Triphenylphosphonium Bromide (Peg-800 Supported) Solvents: Water; 1.5 H,80 °C
  标题:The Suzuki Cross-Coupling Reaction In Pure Water Catalyzed By Ligandless Palladium Using Polyethylene Glycol Derivatives As Surfactant
  作者:Xiang,Liu; Xiaohua,Zhao; Ming,Lu
  参考文献:Applied Organometallic Chemistry 日期:2013 卷标:27(10) 页码:615-618]
  
  92-69-3 = 885-82-5
  反应条件:1.1 Reagents: Tetrabutylammonium Bromide,Nitric Acid Solvents: 1,2-Dichloroethane,Water; 3 H,20 °C
  标题:Nitration Of Phenol And Substituted Phenols With Dilute Nitric Acid Using Phase-Transfer Catalysts
  作者:Joshi,Ashutosh V.; Baidoosi,Mubeen; Mukhopadhyay,Sudip; Sasson,Yoel
  参考文献:Organic Process Research & Development 日期:2003 卷标:7(1) 页码:95-97]
  
  92-69-3 = 885-82-5
  反应条件:1.1 Reagents: 1,3,5-Triazine-2,4,6-Triamine,Nitrate (1:?) Catalysts: P-Toluenesulfonic Acid Solvents: Acetone; 1.5 H,Rt
  标题:Melamine Nitrate,A Novel And Efficient Reagent For Regioselective Nitration Of Phenols
  作者:Chen,Yong-Qiang; Jiang,Hong
  参考文献:Organic Chemistry International 日期:2011 卷标:753142]
  
  92-69-3 = 885-82-5
  反应条件:1.1 Reagents: Silica,Sodium Nitrite,Sodium Bisulfate,Water Solvents: Dichloromethane
  标题:An Efficient Method For Chemoselective Nitration Of Phenols Under Mild And Heterogeneous Conditions
  作者:Zolfigol,Mohammad Ali; Madrakian,Elahe; Ghaemi,Ezat
  参考文献:Indian Journal Of Chemistry 日期:2001 卷标:(12) 页码:1191-1195]
  
  92-69-3 = 885-82-5
  反应条件:1.1 Reagents: Sodium Nitrate Catalysts: Iron Oxide (Fe2O3); 30 Min,Rt
  标题:Highly Efficient Protocol For The Aromatic Compounds Nitration Catalyzed By Magnetically Recyclable Core/shell Nanocomposite
  作者:Maleki,Ali; Aghaei,Morteza; Paydar,Reza
  参考文献:Journal Of The Iranian Chemical Society 日期:2017 卷标:14(2) 页码:485-490]
  
  92-69-3 = 885-82-5
  反应条件:1.1 Reagents: Nitric Acid Solvents: 1,2-Dichloroethane,Water; < 30 °C; 5 H,Rt
  标题:Synthetic Process Of Acaricide Bifenazate
  作者:Liu,An-Chang; Zou,Xiao-Dong; Du,Chang-Feng; Chen,Lu
  参考文献:Nongyao 日期:2014 卷标:53(2) 页码:102-103]
  
  14874-70-5 + 72848-85-2 + 153766-81-5 = 885-82-5
  反应条件:1.1 Catalysts: Palladium Diacetate Solvents: 1,4-Dioxane; 10 Min,20 °C1.2 12 H,20 °C
  标题:Suzuki-Miyaura Cross Coupling Reactions With Phenoldiazonium Salts
  作者:Schmidt,Bernd; Hoelter,Frank
  参考文献:Organic & Biomolecular Chemistry 日期:2011 卷标:9(13) 页码:4914-4920]
  
  92-69-3 = 885-82-5
  反应条件:1.1 Reagents: Sodium Nitrite,1-Butanaminium,N,N,N-Tributyl-,Tetraoxochromate(2-) (2:1) Solvents: Dichloromethane; 69 H,Reflux
  标题:Nitration Of Phenolic Compounds And Oxidation Of Hydroquinones Using Tetrabutylammonium Chromate And Dichromate Under Aprotic Conditions
  作者:Pourali,Ali Reza; Goli,Arezou
  参考文献:Journal Of Chemical Sciences (Bangalore 日期:2011 卷标:123(1) 页码:63-67

海关参考信息

• 2908199090-其他酚的卤化衍生物
  2908999090-其他酚的硝化衍生物
  2918290000-其他含酚基羧酸
  2905199090-其他饱和一元醇
• 💡 提示：海关信息按照顺序优先匹配，如需确认的海关信息，请参考相关资料。
• 详情请参考：📖 海关编码查询和海关进出口税则

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• ➥ 象形图和危险代码
• ➥ 防范代码详解
• ➥ 危险代码说明
• ➥ Globally Harmonized System
• ➥ REACH监管