CAS: 90-99-3; Benzhydryl Chloride

• 英文名称Benzhydryl Chloride
• 中文名称二苯氯甲烷
• IUPAC名称(chloromethylene)dibenzene
• 其它别名Diphenylchloromethane; Benzhydryl chloride; 1,1'-(Chloromethylene)bisbenzene
• CAS编号90-99-3
• MFCD编号:MFCD00000855
• EINECS号:202-031-7
• FDA UNII编号:CN9N9AYV4B
• 分子式:C13H11Cl
• 分子量:202.68
• 产品CID: 1944338
• 产品分类有机原料 → 烃类化合物及其衍生物 → 烃类卤化物

• 相似结构搜索
• InChIKey: ZDVDCDLBOLSVGM-UHFFFAOYSA-N
• InChI=1S/C13H11Cl/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H…
• 计算化学: 氢键受体数0.0氢键供体数0.0可旋转键数2.0

物理性质

• 熔点15-17  °C(文献)
• 沸点315.5±0.0 °C at 760 mmHg
• 闪点127.0±11.4 °C
• 密度1.1±0.1 g/cm3
• PSA:0.0
• LogP:3.96
• 折射率1.582
• 蒸汽压0.0±0.6 mmHg at 25°C
• 溶解性Chloroform (Soluble), Methanol (Sparingly)
• 外观形态透明无色至黄色液体
• 储存条件惰性气氛,室温
• 产品应用苯海拉敏中间体.
• 性质描述熔点16°C,沸点140°C/399Pa,密度1.14,折光率1.5951.

MSDS等安全信息

• GHS象形图
• GHS符号GHS07;
  注释: Exclamation mark
• 危险类别水生慢性毒性 类别2
  皮肤腐蚀 类别1B
  严重眼损伤 类别1
  急性毒性 类别4(吸入)
  急性毒性 类别4(经皮)
  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 类别1
  严重眼刺激 类别2
  皮肤腐蚀/刺激 类别2
• 警示词Warning(警告)
• 危险描述H411 |对水生生物有毒并具有长期持续影响.
  H314 |造成严重皮肤灼伤和眼损伤.
  H318 |造成严重眼损伤.
  H332 |吸入有害.
  H312 |皮肤接触有害.
  H302 |吞咽有害.
  H335 |可能引起呼吸道刺激.
  H319 |造成严重眼刺激.
  H315 |造成皮肤刺激.
• 防范说明P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
• 危险等级8
• UN编号UN 3265 8/PG 2
• 危险品标志Xi,C
• 包装等级III
• 安全声明26-36-24/25-45-36/37/39-27
• 危险类别码36/38-36/37/38-36-34
• WGK Germany3

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 Chlorodiphenylmethane 主要起始原料 Benzhydrol
• 91-01-0 = 90-99-3 [标题:Reaction Conditions
  标题:Synthesis Of Azolylethyl Benzhydryl Ethers,Analogs Of Diphenhydramine
  作者:Burdeinyi,M. L.; Popkov,S. V.; Kharchevnikova,M. V.
  参考文献:Russian Chemical Bulletin 日期:2009 卷标:58(5) 页码:936-939]
  
  91-01-0 = 90-99-3
  反应条件:1.1 Reagents: 1-Hydroxybenzotriazole,Thionyl Chloride Solvents: Dichloromethane
  标题:Thionyl Chloride-Benzotriazole In Methylene Chloride. A Convenient Solution For Conversion Of Alcohols And Carboxylic Acids Expeditiously Into Alkyl Chlorides And Acid Chlorides By Simple Titration
  作者:Chaudhari,Sachin S.; Akamanchi,Krishnacharya G.
  参考文献:Synlett 日期:1999 卷标:(11) 页码:1763-1765]
  
  91-01-0 = 90-99-3
  反应条件:1.1 Reagents: Titanium Tetrachloride,Ammonia Borane Solvents: Diethyl Ether; 0 °C; 1 Min,0 °C; 0.5 H,Rt; Rt -> 0 °C1.2 Reagents: Hydrochloric Acid Solvents: Water; 0 °C
  标题:Balancing Lewis Acidity And Carbocation Stability For The Selective Deoxyhalogenation Of Aryl Carbonyls And Carbinols
  作者:Ramachandran,P. Veeraraghavan; Alawaed,Abdulkhaliq A.; Hamann,Henry J.
  参考文献:Organic Letters 日期:2023 卷标:25(25) 页码:4650-4655]
  
  91-01-0 = 90-99-3
  反应条件:1.1 Reagents: Hydrochloric Acid Catalysts: Tetrabutylammonium Bromide Solvents: Toluene,Water; Rt; 6 - 7 H,40 - 45 °C
  标题:Stereoselective Synthesis Of (Z)-1-Benzhydryl-4-Cinnamylpiperazines Via The Wittig Reaction
  作者:Shivprakash,S.; Reddy,G. Chandrasekara
  参考文献:Synthetic Communications 日期:2014 卷标:44(5) 页码:600-609]
  
  91-01-0 = 90-99-3
  反应条件:1.1 Reagents: Triethylamine,Selenium Tetrachloride Solvents: Toluene
  标题:Selenium And Tellurium Tetrachlorides As Reagents For The Conversion Of Alcohols To Alkyl Chlorides And Tellurium Tetrachloride As A Lewis Acid Catalyst For Aromatic Alkylation
  作者:Yamauchi,Takayoshi; Hattori,Kaneaki; Mizutaki,Shoichi; Tamaki,Kentaro; Uemura,Sakae
  参考文献:Bulletin Of The Chemical Society Of Japan 日期:1986 卷标:59(11) 页码:3617-20]
  
  91-01-0 = 90-99-3
  反应条件:1.1 Reagents: Tin Tetrachloride
  标题:A Simple Method For The Conversion Of Adamantyl,Benzyl And Benzyhydryl Alcohols To Their Corresponding Bromides And Chlorides And The Transhalogenation Of Adamantyl,Benzyl,Benzhydryl And Tertiary Alkyl Bromides And Chlorides
  作者:Amrollah-Madjdabadi,A.; Pham,Tung N.; Ashby,E. C.
  参考文献:Synthesis 日期:1989 卷标:(8) 页码:614-16]
  
  = 90-99-3
  反应条件:1.1 Reagents: Tributyltin Chloride; 4 H,50 °C
  标题:Substitution Reactions On Carbon Utilizing Organotin Reagents
  作者:Vartanian,Paul F.
  参考文献:1974]
  
  91-01-0 = 90-99-3
  反应条件:1.1 Reagents: Tetrabutylammonium Bromide,Hydrochloric Acid Solvents: Water; 40 - 45 °C
  标题:Design,Synthesis,And Molecular Docking Study Of New Piperazine Derivative As Potential Antimicrobial Agents
  作者:Patil,Mahadev; Noonikara Poyil,Anurag; Joshi,Shrinivas D.; Patil,Shivaputra A.; Patil,Siddappa A.; Et Al
  参考文献:Bioorganic Chemistry 日期:2019 卷标:92]
  
  574-42-5 = 90-99-3
  反应条件:1.1 Reagents: Chlorotrimethylsilane Catalysts: Montmorillonite ((Al1.33-1.67Mg0.33-0.67)(Ca0-1Na0-1)0.33Si4(Oh)2O10.Xh2O) Solvents: Dichloromethane; 40 Min,Rt
  标题:Chlorination Of Benzylic And Allylic Alcohols With Trimethylsilyl Chloride Enhanced By Natural Sodium Montmorillonite
  作者:Tandiary,Michael Andreas; Masui,Yoichi; Onaka,Makoto
  参考文献:Synlett 日期:2014 卷标:25(18) 页码:2639-2643]
  
  1016-09-7 = 90-99-3
  反应条件:1.1 Reagents: Hydrochloric Acid Solvents: Water
  标题:Alkyl-Oxygen Fission In Carboxylic Esters. Ii. Derivatives Of P-Methoxybenzohydryl
  作者:Balfe,Michael P.; Doughty,Mark A.; Kenyon,Joseph; Poplett,Reginald
  参考文献:Journal Of The Chemical Society 日期:1942 卷标:605 页码:605-11]
  
  91-01-0 = 90-99-3
  反应条件:1.1 Reagents: Hydrochloric Acid Solvents: Water; 10 Min,100 °C
  标题:Continuous-Flow Multistep Synthesis Of Cinnarizine,Cyclizine,And A Buclizine Derivative From Bulk Alcohols
  作者:Borukhova,Svetlana; Noel,Timothy; Hessel,Volker
  参考文献:Chemsuschem 日期:2016 卷标:9(1) 页码:67-74]
  
  91-01-0 = 90-99-3
  反应条件:1.1 Reagents: Chlorotrimethylsilane; 4 H,Rt
  标题:Direct Halogenation Of Alcohols With Halosilanes Under Catalyst- And Organic Solvent-Free Reaction Conditions
  作者:Ajvazi,Njomza; Stavber,Stojan
  参考文献:Tetrahedron Letters 日期:2016 卷标:57(22) 页码:2430-2433]
  
  91-01-0 = 90-99-3
  反应条件:1.1 Reagents: Oxalyl Chloride Catalysts: Triphenylphosphine Oxide Solvents: Chloroform; 5 Min,Rt1.2 Reagents: Oxalyl Chloride Solvents: Chloroform; 7 H,Rt
  标题:Catalytic Phosphorus(V)-Mediated Nucleophilic Substitution Reactions: Development Of A Catalytic Appel Reaction
  作者:Denton,Ross M.; An,Jie; Adeniran,Beatrice; Blake,Alexander J.; Lewis,William; Et Al
  参考文献:Journal Of Organic Chemistry 日期:2011 卷标:76(16) 页码:6749-6767]
  
  91-01-0 = 90-99-3
  反应条件:1.1 Reagents: Hydrochloric Acid,Calcium Chloride Solvents: Water; Rt; 4 H,90 °C
  标题:A Novel Synthetic Approach To Diarylmethylpiperazine Drugs
  作者:Yu,Tian; Dong,Hongbo; Shi,Zheng; Cheng,Lijia; Guo,Xiaoheng; Et Al
  参考文献:Letters In Organic Chemistry 日期:2018 卷标:15(6) 页码:485-490]
  
  = 90-99-3
  反应条件:1.1 Solvents: Acetonitrile; 16 H,Reflux
  标题:Synthesis Of New Camphor-Based Carbene Ligands And Their Application In A Copper-Catalyzed Michael Addition With B2Pin2
  作者:Koppenwallner,Maximilian; Rais,Eduard; Uzarewicz-Baig,Magdalena; Tabassum,Sobia; Gilani,Mazhar Amjad; Et Al
  参考文献:Synthesis 日期:2015 卷标:47(6) 页码:789-800

海关参考信息

• 2902300000-甲苯
  2903110000-一氯甲烷及氯乙烷
• 💡 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

专利信息

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• ➥ 象形图和危险代码
• ➥ 防范代码详解
• ➥ 危险代码说明
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