CAS: 91-00-9; Diphenylmethanamine

• 英文名称Diphenylmethanamine
• 中文名称二苯甲胺
• IUPAC名称diphenylmethanamine
• 其它别名甲基胺二苯; α-Aminodiphenylmethane
• CAS编号91-00-9
• MFCD编号:MFCD00008059
• EINECS号:202-032-2
• FDA UNII编号:4BO6ISS9DX
• 分子式:C13H13N
• 分子量:183.25
• 产品CID: 1944536
• 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: MGHPNCMVUAKAIE-UHFFFAOYSA-N
• InChI=1S/C13H13N/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H,14H2…
• 计算化学: 氢键受体数1.0氢键供体数1.0可旋转键数2.0

物理性质

• 熔点12°C
• 沸点301.1°C at 760 mmHg
• 闪点113°C
• 密度1.1±0.1 g/cm3
• pKa:8.41±0.10(预测)
• PSA:26.02
• LogP:2.7347
• 折射率1.598
• 蒸汽压0.0±0.6 mmHg at 25°C
• 溶解性Chloroform, DMSO, Methanol
• 敏感性空气敏感
• 外观形态透明无色至黄色液体
• 储存条件在惰性气体(氮气或氩气)下 2–8 °C
• 产品应用该化合物用于通过对呋喃-2-碳基氯化物作出反应来制备呋喃-2-碳基酸乙酰氰胺.
• 性质描述无色透明液体或结晶.沸点293-295°C.熔点12°C.密度1.063g/mLat25°C,折光率n20/D1.595

MSDS等安全信息

• GHS象形图
• GHS符号GHS07;
  注释: Exclamation mark
• 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
  严重眼刺激 类别2
  皮肤腐蚀 类别1B
  严重眼损伤 类别1
  急性毒性 类别2(吸入)
  急性毒性 类别3(经皮)
  急性毒性 类别3(经口)
  严重眼刺激 类别2A
• 警示词Warning(警告)
• 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.
  H319 |造成严重眼刺激.
  H314 |造成严重皮肤灼伤和眼损伤.
  H318 |造成严重眼损伤.
  H330 |吸入致命.
  H311 |皮肤接触会中毒.
  H301 |吞咽会中毒.
• 防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
• 危险等级8
• UN编号2810
• 危险品标志Xn,Xi
• 包装等级III
• 安全声明26-36
• 危险类别码22-36/37/38
• WGK Germany3

欧盟法规

上下游产品

合成工艺路线路线简述

• 128170-63-8 = 91-00-9
  反应条件:1.1 Reagents: Zinc Solvents: Tetrahydrofuran
  标题:Mild And Chemoselective Cleavage Of P-Nitrobenzyl Esters And P-Nitrobenzyloxycarbonylamines With Zinc Dust
  作者:Kumagai,Toshio; Abe,Takao; Fujimoto,Yukari; Hayashi,Takaaki; Inoue,Yoshinori; Et Al
  参考文献:Heterocycles 日期:1993 卷标:36(8) 页码:1729-34]
  
  17599-59-6 = 91-00-9
  反应条件:1.1 Reagents: Lithium Aluminum Hydride
  标题:Synthesis Of Secondary And Tertiary Carbinamines From N-(Trimethylsilyl)Imines And Organolithium Reagents
  作者:Hirao,Akira; Hattori,Iwakazu; Yamaguchi,Kazuo; Nakahama,Seiichi; Yamazaki,Noboru
  参考文献:Synthesis 日期:1982 卷标:(6) 页码:461-2]
  
  1013-88-3 = 91-00-9
  反应条件:1.1 Reagents: Sodium Borohydride
  标题:α-Phenyl-Benzenemethanamine And α-Phenyl-Benzenemethanamine Hydrochloride
  作者:Pigza,Julie A.
  参考文献:E-Eros Encyclopedia Of Reagents For Organic Synthesis 日期:2011 卷标:1 页码:1-4]
  
  1013-88-3 = 91-00-9
  反应条件:1.1 Reagents: Ammonia Borane Solvents: Thf-D8; 14 D,60 °C; 60 °C -> Rt
  标题:Transfer Hydrogenation Of Imines With Ammonia-Borane: A Concerted Double-Hydrogen-Transfer Reaction
  作者:Yang,Xianghua; Zhao,Lili; Fox,Thomas; Wang,Zhi-Xiang; Berke,Heinz
  参考文献:Angewandte Chemie 日期:2010 卷标:49(11) 页码:2058-2062]
  
  21420-61-1 = 91-00-9
  反应条件:1.1 Reagents: Trifluoroacetic Acid Solvents: Dichloromethane; 30 Min,60 °C1.2 Reagents: Amberlyst A 21; 30 Min
  标题:Rapid Deprotection Of N-Boc Amines By Tfa Combined With Free Base Generation Using Basic Ion-Exchange Resins
  作者:Srinivasan,Natarajan; Yurek-George,Alexander; Ganesan,A.
  参考文献:Molecular Diversity 日期:2005 卷标:9(4) 页码:291-293]
  
  1013-88-3 = 91-00-9
  反应条件:1.1 Reagents: Sodium Borohydride Solvents: Diethyl Ether,Methanol
  标题:Synthesis Of Substituted Benzhydrylamines
  作者:Dejaegher,Yves; Mangelinckx,Sven; De Kimpe,Norbert
  参考文献:Synlett 日期:2002 卷标:(1) 页码:113-115]
  
  6926-47-2 = 91-00-9
  反应条件:1.1 Reagents: Triethylamine,2-Dodecyl-1,3-Propanedithiol Catalysts: Trioctylmethylammonium Chloride Solvents: Methanol; Rt
  标题:Preparation And Application Of Odorless 1,3-Propanedithiol Reagents
  作者:Matoba,Manabu; Kajimoto,Tetsuya; Nishide,Kiyoharu; Node,Manabu
  参考文献:Chemical & Pharmaceutical Bulletin 日期:2006 卷标:54(1) 页码:141-146]
  
  22815-70-9 = 91-00-9
  反应条件:1.1 Reagents: Diethylamine Catalysts: Palladium Diacetate,Di-O-Methyl-β-Cyclodextrin,Benzenesulfonic Acid,3,3′,3′′-Phosphinidynetris-,Sodium Salt (1:3) Solvents: Toluene,Water
  标题:Convenient Cleavage Of Water-Insoluble Allylic Substrates In The Presence Of Per(2,6-Di-O-Methyl)-β-Cyclodextrin
  作者:Widehem,Rodrigue; Lacroix,Thibaut; Bricout,Herve; Monflier,Eric
  参考文献:Synlett 日期:2000 卷标:(5) 页码:722-724]
  
  574-66-3 = 91-00-9
  反应条件:1.1 Catalysts: Iron Oxide (Fe3O4),Zirconium Chloride (Zrcl4); Rt -> 80 °C1.2 Reagents: Sodium Cyanoborohydride; 75 - 80 °C; 50 Min,75 - 80 °C
  标题:The Efficient Solvent-Free Reduction Of Oximes To Amines With Nabh3Cn Catalyzed By Zrcl4/nano Fe3O4 System
  作者:Sadighnia,Leila; Zeynizadeh,Behzad
  参考文献:Journal Of The Iranian Chemical Society 日期:2015 卷标:12(5) 页码:873-878]
  
  66075-00-1 = 91-00-9
  反应条件:1.1 Reagents: Pyridine,Water; 24 H,Reflux
  标题:Lewis Acid-Catalyzed Nucleophilic Substitutions Of Benzylic Alcohols With Sulfamides
  作者:Oda,Ryoga; Nakata,Kenya
  参考文献:European Journal Of Organic Chemistry 日期:2021 卷标:2021(2) 页码:295-301]
  
  21420-61-1 = 91-00-9
  反应条件:1.1 Reagents: Sodium Tert-Butoxide,Water Solvents: Tetrahydrofuran; 2 - 12 H,Reflux; Reflux -> Rt1.2 Reagents: Citric Acid Solvents: Water; 30 - 60 Min,Rt1.3 Reagents: Sodium Hydroxide Solvents: Water; Ph 10 - 12,Rt
  标题:Deprotection Of A Primary Boc Group Under Basic Conditions
  作者:Tom,Norma J.; Simon,Wendy M.; Frost,Heather N.; Ewing,Marcus
  参考文献:Tetrahedron Letters 日期:2004 卷标:45(5) 页码:905-906]
  
  6926-47-2 = 91-00-9
  反应条件:1.1 Reagents: Phosphine,[4-(1R,2R,4R)-Bicyclo[2.2.1]Hept-5-En-2-Ylphenyl]Diphenyl-,Rel-,Tri... Solvents: Tetrahydrofuran
  标题:Rompgel-Supported Triphenylphosphine With Potential Application In Parallel Synthesis
  作者:Aarstad,Erik; Barrett,Anthony G. M.; Hopkins,Brian T.; Koebberling,Johannes
  参考文献:Organic Letters 日期:2002 卷标:4(11) 页码:1975-1977]
  
  150646-20-1 = 91-00-9
  反应条件:1.1 Catalysts: 1,4-Bis(Diphenylphosphino)Butane,Bis(Dibenzylideneacetone)Palladium Solvents: Tetrahydrofuran1.2 Reagents: 2-Mercaptobenzoic Acid Solvents: Tetrahydrofuran
  标题:Selective Deprotection Of Allyl Amines Using Palladium
  作者:Lemaire-Audoire,Sandrine; Savignac,Monique; Genet,Jean Pierre; Bernard,Jean-Marie
  参考文献:Tetrahedron Letters 日期:1995 卷标:36(8) 页码:1267-70]
  
  574-66-3 = 91-00-9
  反应条件:1.1 Reagents: Sodium Solvents: Ethanol
  标题:Rearrangements Of Some New Hydroxamic Acids Related To Heterocyclic Acids And To Diphenyl- And Triphenylacetic Acids
  作者:Jones,Lauder W.; Hurd,Charles D.
  参考文献:Journal Of The American Chemical Society 日期:1921 卷标:43 页码:2422-48]
  
  574-66-3 = 91-00-9
  反应条件:1.1 Reagents: Alumina,Zirconium Chloride (Zrcl4)1.2 > 1 Min,Rt1.3 Reagents: Sodium Borohydride; 2 Min,Rt
  标题:A Rapid And Practical Protocol For Solvent-Free Reduction Of Oximes To Amines With Nabh4/zrcl4/al2O3 System
  作者:Zeynizadeh,Behzad; Kouhkan,Mehri
  参考文献:Bulletin Of The Korean Chemical Society 日期:2011 卷标:32(9) 页码:3448-3452]
  
  6926-47-2 = 91-00-9
  反应条件:1.1 Reagents: Indium,Hydrochloric Acid Solvents: Tetrahydrofuran
  标题:Indium-Mediated Reduction Of Nitro And Azide Groups In The Presence Of HCL In Aqueous Media
  作者:Lee,Jung Gyu; Choi,Kyung Il; Koh,Hun Yeong; Kim,Youseung; Kang,Yonghan; Et Al
  参考文献:Synthesis 日期:2001 卷标:(1) 页码:81-84]
  
  1013-88-3 = 91-00-9
  反应条件:1.1 Reagents: Phenylsilane Catalysts: Lithium Triethylborohydride Solvents: Tetrahydrofuran; 2 H,45 °C1.2 Reagents: Potassium Hydroxide Solvents: Methanol,Water; 2 H,Rt
  标题:Experimental And Computational Studies Of Borohydride Catalyzed Hydrosilylation Of A Variety Of C:O And C:N Functionalities Including Esters,Amides And Heteroarenes
  作者:Manas,Michael G.; Sharninghausen,Liam S.; Balcells,David; Crabtree,Robert H.
  参考文献:New Journal Of Chemistry 日期:2014 卷标:38(4) 页码:1694-1700]
  
  1013-88-3 = 91-00-9
  反应条件:1.1 Reagents: Hydrogen Solvents: Isopropanol
  标题:Photochemical Oxidation Of Imines
  作者:Toshima,Naoki; Hirai,Hidefumi
  参考文献:Tetrahedron Letters 日期:1970 卷标:(6) 页码:433-6

海关参考信息

• 2902300000-甲苯
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