CAS: 923595-49-7; 6-Chloro-3-Iodoimidazo[1,2-B]Pyridazine

• 英文名称6-Chloro-3-Iodoimidazo[1,2-B]Pyridazine
• 中文名称6-氯-3-碘咪唑并[1,2-b]哒嗪
• IUPAC名称6-chloro-3-iodoimidazo[1,2-b]pyridazine
• 其它别名3-碘-6-氯咪唑并(1,2B)哒嗪; 6-Chloro-3-Iodoimidazo[1,2-B]Pyridazine
• CAS编号923595-49-7
• MFCD编号:MFCD11044749
• EINECS号:851-079-0
• 分子式:C6H3ClIN3
• 分子量:279.47
• 产品CID: 1961454
• 产品分类有机原料→分子砌块→芳杂环类化合物→哒嗪类化合物

• 相似结构搜索
• InChIKey: IWHCPHZAMFSDFM-UHFFFAOYSA-N
• InChI=1S/C6H3ClIN3/c7-4-1-2-6-9-3-5(8)11(6)10-4/h1-3H…
• 计算化学: 氢键受体数3.0氢键供体数0.0可旋转键数0.0

相似化合物

物理性质

• 密度2.3±0.1 g/cm3
• pKa:1.03±0.30(预测)
• PSA:30.19
• LogP:1.9873
• 折射率1.832
• 外观形态固体
• 储存条件在惰性气体(氮气或氩气)下 2–8 °C

MSDS等安全信息

• GHS符号GHS07
• 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2A
• 警示词Warning
• 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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
• 危险品标志Xi
• 安全声明36/37
• 危险类别码43

欧盟法规

上下游产品

合成工艺路线路线简述

• 6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide Solvents: Methanol; Overnight,Reflux1.2 Reagents: Sodium Thiosulfate Solvents: Water
  标题:Preparation Of Amino Pyrimidine Compounds For Inhibiting Protein Tyrosine Kinase Activity
  参考文献:World Intellectual Property Organization]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide Solvents: Chloroform; Overnight,Rt
  标题:Preparation Of Imidazopyridine Compounds As Mixed Lineage Kinase Inhibitors
  参考文献:United States]
  
  = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide,Silver Fluoride Solvents: Acetonitrile; 2 H,Rt
  标题:Intermolecular C-H Silylation Of Unactivated Arenes
  参考文献:World Intellectual Property Organization]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: Boron Trifluoride Etherate,Zincate(2-),Dichlorobis(2,2,6,6-Tetramethyl-1-Piperidinyl)-,Lithium Magnesium ... Solvents: Tetrahydrofuran; 20 Min,-20 °C1.2 Reagents: Iodine; Rt1.3 Reagents: Ammonium Chloride Solvents: Water
  标题:Reliable Functionalization Of 5,6-Fused Bicyclic N-Heterocycles Pyrazolopyrimidines And Imidazopyridazines Via Zinc And Magnesium Organometallics
  作者:Kumar Rout,Saroj; Kastrati,Agonist; Jangra,Harish; Schwarzer,Kuno; Sunagatullina,Alisa S.; Et Al
  参考文献:Chemistry - A European Journal 日期:2022 卷标:28(33)]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: Iodine Solvents: Dimethyl Sulfoxide; 36 H,Rt
  标题:Nitrogen Bicyclic Compounds As Inhibitors For Scyl1 And Grk5 And Their Preparation
  参考文献:European Patent Organization]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide Solvents: Dimethylformamide; 8 H,60 °C1.2 Reagents: Water; 0 °C
  标题:Discovery Of Imidazo[1,2-B]Pyridazine Macrocyclic Derivatives As Novel Alk Inhibitors Capable Of Combating Multiple Resistant Mutants
  作者:Xiao,Xiaofei; Xu,Yunsheng; Yu,Xihua; Chen,Yinbo; Zhao,Weiwei; Et Al
  参考文献:Bioorganic & Medicinal Chemistry Letters 日期:2023 卷标:89]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide; Rt
  标题:Process For Preparation Of 3-Iodo-6-Chloro-Imidazo[1,2-B]Pyridazine
  参考文献:China]
  
  = 923595-49-7 [标题:Reaction Conditions
  标题:Preparation Of 6-Aminoimidazo[1,2-B]Pyridazines As Kinase Inhibitors
  参考文献:World Intellectual Property Organization]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide Solvents: Dimethylformamide; 48 H,23 °C
  标题:Heterocycle Derivatives As Inhibitors Of Lin28,Methods Of Use And Preparation
  参考文献:World Intellectual Property Organization]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide Solvents: Dimethylformamide; 4 D,Rt
  标题:Medicinal Chemistry Optimization Of Antiplasmodial Imidazopyridazine Hits From High Throughput Screening Of A Softfocus Kinase Library: Part 1
  作者:Le Manach,Claire; Gonzalez Cabrera,Diego; Douelle,Frederic; Nchinda,Aloysius T.; Younis,Yassir; Et Al
  参考文献:Journal Of Medicinal Chemistry 日期:2014 卷标:57(6) 页码:2789-2798]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide Solvents: Methanol; Overnight,Reflux1.2 Reagents: Sodium Thiosulfate Solvents: Water
  标题:Process For Preparation Of Amino Pyrimidine Compound For Inhibiting Protein Tyrosine Kinase Activity
  参考文献:World Intellectual Property Organization]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide Solvents: Dimethylformamide; 3 H,Rt -> 90 °C; 90 °C -> 40 °C1.2 Reagents: Water; 0 °C
  标题:Synthesis Of 3-Iodo-6-Chloroimidazo[1,2-B]Pyridazine
  作者:Cheng,Wei; Zhang,Xiang-Long; Chen,Qi-Xu; Yuan,Wen-Peng
  参考文献:Huaxue Shiji 日期:2020 卷标:42(12) 页码:1492-1496]
  
  = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide,Silver Fluoride Solvents: Acetonitrile; 2 H,Rt
  标题:Iridium-Catalyzed Silylation Of Aryl C-H Bonds
  作者:Cheng,Chen; Hartwig,John F.
  参考文献:Journal Of The American Chemical Society 日期:2015 卷标:137(2) 页码:592-595]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide Solvents: Acetonitrile; Rt -> 60 °C; 10 H,60 °C
  标题:Substituted Benzofuran Compounds And Methods Of Use Thereof For The Treatment Of Viral Diseases
  参考文献:World Intellectual Property Organization]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide Solvents: Dimethylformamide; 15 H,90 °C1.2 Reagents: Water; 1 H
  标题:Discovery Of Potent,Selective,And Brain-Penetrant 1H-Pyrazol-5-Yl-1H-Pyrrolo[2,3-B]Pyridines As Anaplastic Lymphoma Kinase (Alk) Inhibitors
  作者:Fushimi,Makoto; Fujimori,Ikuo; Wakabayashi,Takeshi; Hasui,Tomoaki; Kawakita,Youichi; Et Al
  参考文献:Journal Of Medicinal Chemistry 日期:2019 卷标:62(10) 页码:4915-4935]
  
  6775-78-6 = 923595-49-7
  反应条件:1.1 Reagents: N-Iodosuccinimide Solvents: Dimethylformamide; 12 H,Rt
  标题:Function-Oriented Synthesis Of Imidazo[1,2-A]Pyrazine And Imidazo[1,2-B]Pyridazine Derivatives As Potent Pi3K/mtor Dual Inhibitors
  作者:Li,Chuchu; Han,Yuqiao; Wang,Zhengyang; Yu,Yanan; Wang,Chen; Et Al
  参考文献:European Journal Of Medicinal Chemistry 日期:2023 卷标:247

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