CAS: 953789-37-2; 2-Chloro-N-(4-Chlorophenethyl)Propan-1-Amine Hydrochloride

• 英文名称2-Chloro-N-(4-Chlorophenethyl)Propan-1-Amine Hydrochloride
• 中文名称N-(2-氯丙基)-4-氯苯乙基胺盐酸盐
• 其它别名1-[[2-(4-氯苯基)乙基]氨基]-2-氯丙烷盐酸盐; Lorcaserin Intermediate
• CAS编号953789-37-2
• MFCD编号:MFCD11046660
• EINECS号:810-479-5
• 分子式:C11H15Cl2N
• 分子量:268.61
• 产品CID: 2006824
• 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: ARSNVFGYXNWTPK-UHFFFAOYSA-N
• 1S/C11H15Cl2N.ClH/c1-9(12)8-14-7-6-10-2-4-11(13)5-3-10;/h2-5,9,14H,6-8H2,1H3;1H…
• 计算化学: 氢键受体数1.0氢键供体数1可旋转键数5

物理性质

• 熔点>170°C
• PSA:12.03
• LogP:3.5212
• 溶解性DMSO (Slightly), Methanol (Slightly)
• 外观形态白色至类白色固体
• 储存条件密封, 常温干燥保存
• 产品应用该化合物用于LORCASRIN合成剂(L469890,HCL)的试剂;一种新型的有选择性的5-HT2C-受体激动剂治疗肥胖症.

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
• 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.
• 防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
• 安全声明H303+H313+H333

欧盟法规

上下游产品

合成工艺路线路线简述

• 1637648-95-3 = 953789-37-2
  反应条件:1.1 Reagents: Chlorotrimethylsilane,Aluminum Chloride,Sodium Borohydride Solvents: Tetrahydrofuran; Rt -> 70 °C; 24 H,70 °C; 70 °C -> Rt1.2 Reagents: Water1.3 Reagents: Sodium Hydroxide Solvents: Water; 30 Min,Ph 14,Rt1.4 Reagents: Hydrochloric Acid Solvents: Ethyl Acetate; 30 Min,Rt
  标题:A Concise Synthesis Of Racemic Lorcaserin
  作者:Xu,Bin; Su,Jincai; Wang,Jing; Zhou,Guo-Chun
  参考文献:Australian Journal Of Chemistry 日期:2016 卷标:69(7) 页码:770-774]
  
  2486273-06-5 = 953789-37-2
  反应条件:1.1 Reagents: Sulfuric Acid Solvents: Water; Rt -> 120 °C; 2 H,120 °C
  标题:Preparation Method Of Lorcaserin
  参考文献:China]
  
  847063-13-2 = 953789-37-2
  反应条件:1.1 Reagents: Thionyl Chloride Solvents: Toluene,Dimethylacetamide; 50 - 55 °C; 20 - 30 Min,50 - 55 °C; 55 - 60 °C; 3 - 4 H,55 - 60 °C; 25 - 30 °C1.2 Solvents: Isopropanol; 30 Min,25 - 30 °C
  标题:Process For Preparation Of Lorcaserin Intermediate
  参考文献:China]
  
  78-96-6 + 32327-70-1 = 953789-37-2
  反应条件:1.1 1 H,80 °C -> 93 °C; 2 H,90 - 95 °C1.2 Solvents: Chlorobenzene,Water; 95 °C -> 74 °C; 15 Min,70 - 75 °C; 75 °C -> 50 °C1.3 Reagents: Thionyl Chloride; 55 Min,56 °C -> 64 °C; 4 H,60 - 65 °C1.4 Solvents: Isopropanol; 65 °C -> 67 °C; 67 °C -> Reflux; 2 H,Reflux
  标题:Processes For Preparation Of 2-Chloro-N-(4-Chlorophenethyl)Propan-1-Amine Hydrochloride
  参考文献:World Intellectual Property Organization]
  
  78-96-6 + 6529-53-9 = 953789-37-2
  反应条件:1.1 Rt -> 90 °C; 45 Min,< 100 °C; 90 Min,85 - 100 °C; 100 °C -> 50 °C1.2 Solvents: Water1.3 Reagents: Thionyl Chloride Solvents: Isopropanol; 0 - 5 °C; 2 Min,0 - 5 °C; 1.5 - 2.5 H
  标题:Processes For Preparation Of 8-Chloro-1-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine And Intermediates
  参考文献:World Intellectual Property Organization]
  
  847063-13-2 = 953789-37-2
  反应条件:1.1 Reagents: Thionyl Chloride Catalysts: Dimethylformamide Solvents: Toluene; 1 H,45 - 65 °C; 1 H,55 - 60 °C; 2 H,0 - 5 °C
  标题:Process For Preparation Of Lorcaserin Hydrochloride Hemihydrate
  参考文献:China]
  
  1638542-85-4 = 953789-37-2 + 1431697-94-7
  反应条件:1.1 Catalysts: Aluminum Chloride; Rt -> 85 °C1.2 Reagents: Sodium Chloride Solvents: Water; 20 °C1.3 Solvents: Dichloromethane; Overnight,20 °C1.4 Reagents: Sodium Hydroxide Solvents: Water
  标题:Development And Optimization Of A New Synthetic Process For Lorcaserin
  作者:Cluzeau,Jerome; Stavber,Gaj
  参考文献:Bioorganic & Medicinal Chemistry 日期:2018 卷标:26(4) 页码:977-983]
  
  1463880-66-1 = 953789-37-2
  反应条件:1.1 Reagents: Boron Trifluoride Etherate,Sodium Borohydride Solvents: Tetrahydrofuran; 30 Min,0 - 5 °C1.2 Solvents: Tetrahydrofuran; 0 - 5 °C; 4 - 5 H,60 - 65 °C; 65 °C -> 20 °C1.3 Reagents: Hydrochloric Acid Solvents: Water; 15 Min,10 - 20 °C1.4 Reagents: Hydrochloric Acid Solvents: Toluene,Water; 30 Min,30 - 40 °C1.5 Reagents: Sodium Hydroxide Solvents: Water; Ph 11 - 131.6 Reagents: Hydrochloric Acid Solvents: Water; 15 - 30 Min,Ph 2 - 4,0 - 20 °C
  标题:A Process For The Preparation Of Lorcaserin Hydrochloride
  参考文献:India]
  
  = 953789-37-2 [标题:Reaction Conditions
  标题:Processes For The Preparation Of 8-Chloro-1-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine And Intermediates Related Thereto
  参考文献:United States]
  
  847063-13-2 = 953789-37-2
  反应条件:1.1 Reagents: Thionyl Chloride Catalysts: Dimethylacetamide Solvents: Toluene; 5 - 10 Min,50 - 60 °C; 3 H,60 - 65 °C
  标题:A Process For Preparing 1-[[2-(4-Chlorophenyl)Ethyl]Amino]-2-Propanol And Its Salts
  参考文献:China]
  
  1030624-41-9 = 953789-37-2
  反应条件:1.1 Reagents: Thionyl Chloride Solvents: Toluene,Dimethylacetamide; Rt -> 50 °C; 50 - 60 °C; 2.5 H,60 °C -> 65 °C
  标题:Processes For Preparing (R)-8-Chloro-1-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine Intermediates Toward Serotonin-2C (5-Ht2C) Receptor Agonists
  参考文献:World Intellectual Property Organization]
  
  847063-13-2 = 953789-37-2
  反应条件:1.1 Reagents: Thionyl Chloride Solvents: Toluene,Dimethylacetamide; Rt; < 60 °C; 27 Min,< 60 °C
  标题:Microwave-Assisted Synthesis Of Lorcaserin Hydrochloride
  作者:Zeng,Bi-Tao; Zhu,Tao; Wang,Tian-Xia
  参考文献:Huaxue Shiji 日期:2016 卷标:38(9) 页码:917-920]
  
  34164-14-2 = 953789-37-2
  反应条件:1.1 Solvents: Tetrahydrofuran; 1 - 2 H,0 - 10 °C1.2 Reagents: Boron Trifluoride Etherate; 0 - 10 °C; 2 H,60 - 65 °C1.3 Reagents: Hydrochloric Acid Solvents: Tetrahydrofuran; 5 - 15 °C; 1 H,90 - 100 °C1.4 Reagents: Sodium Hydroxide Solvents: Water; 15 Min,Ph 8.5 - 9.5,5 - 15 °C1.5 Reagents: Hydrochloric Acid Solvents: Water; 2 H,Ph 1 - 2,5 - 15 °C
  标题:An Improved Process For The Preparation Of Lorcaserin Hydrochloride Intermediate N-(4-Chlorophenethyl)-2-Chloropropan-1-Amine Or Salt Thereof
  参考文献:India]
  
  78-96-6 + 1875-88-3 = 953789-37-2
  反应条件:1.1 Reagents: Phosphorus Tribromide; 3 H,80 °C; 80 °C -> Rt1.2 Reagents: Water; Rt1.3 4 H,90 °C; 90 °C -> Rt1.4 Reagents: Thionyl Chloride Catalysts: Dimethylacetamide Solvents: Toluene; 3 H,70 °C1.5 Reagents: Water
  标题:Process For Preparing A Chlorophenylethylpropanamine Compound
  作者:Anonymous
  参考文献:Ip.Com Journal 日期:2015 卷标:16 页码:1-3]
  
  847063-13-2 = 953789-37-2
  反应条件:1.1 Reagents: Thionyl Chloride Solvents: Dimethylformamide,Toluene; 3 H,65 °C
  标题:Synthesis Of Lorcaserin And Method For Preparing Intermediate Of Lorcaserin
  参考文献:China]
  
  78-96-6 + 1875-88-3 = 953789-37-2
  反应条件:1.1 Reagents: Hydrogen Bromide; Rt -> 100 °C; 4.5 H,1.38 - 1.93 Bar1.2 85 °C; 2 H,85 - 95 °C1.3 Reagents: Thionyl Chloride Solvents: Toluene,Dimethylacetamide; 50 °C; < 60 °C; 4 H,60 - 65 °C
  标题:Processes For Preparation Of 4-Chloro-N-(2-Chloropropyl)-Benzeneethanamine Hydrochloride
  参考文献:World Intellectual Property Organization]
  
  = 953789-37-2 [标题:Reaction Conditions
  标题:Processes For Preparing (R)-8-Chloro-1-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine And Intermediates Thereof
  参考文献:United States]
  
  = 953789-37-2 [标题:Reaction Conditions
  标题:Process For The Preparation Of 8-Chloro-1-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine
  参考文献:China

海关参考信息

• 2902600000-乙苯
  2903919090-氯苯
  2903110000-一氯甲烷及氯乙烷
  2903991000-对氯甲苯
• 💡 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

其他信息查阅

• ➥ 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