CAS: 791642-68-7; 4-Bromo-1-Iodo-2-Methoxybenzene

该化合物是一种卤化芳香化合物,在混合氧代苯环上同时含有溴和碘替代成分,这种结构使它成为有机合成的多种中间体,特别是在诸如铃木,Stille或Sonogashira的交叉反应中,其双重卤素功能允许选择性地发挥功能. 电子施肥的甲氧基组的存在进一步增强了其在电光替代反应中的再活动. 其明确界定的再活动性特征和在标准条件下的稳定使其成为制药和农用化学研究的宝贵试剂,以及需要精确芳香建筑的材料科学应用.

英文名称4-Bromo-1-Iodo-2-Methoxybenzene
中文名称4-溴-1-碘-2-甲氧基苯
IUPAC名称4-bromo-1-iodo-2-methoxybenzene
其它别名2-碘-5-溴苯甲醚; 5-Bromo-2-Iodoanisole; 4-Bromo-1-Iodo-2-Methoxybenzene
CAS编号791642-68-7
MFCD编号:MFCD11847482
EINECS号:696-084-7
分子式:C7H6BrIO分子量:312.93
产品CID: 1785980
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: ZQPKPGBEEFOTEK-UHFFFAOYSA-N
InChI=1S/C7H6BrIO/c1-10-7-4-5(8)2-3-6(7)9/h2-4H,1H3
计算化学: 氢键受体数1.0氢键供体数*可旋转键数1.0

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(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/刺激类别2
严重眼刺激类别2A
严重眼刺激类别2
警示词Warning(警告)
危险描述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.
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

欧盟法规

ECHA物质C&L通报

上下游产品

合成工艺路线路线简述

59557-91-4 = 791642-68-7
反应条件:1.1 Reagents: Sodium Nitrite,Hydrochloric Acid,Potassium Iodide Solvents: Water
标题:Ortho-C-H Methoxylation Of Aryl Halides Enabled By A Polarity-Reversed N-O Reagent
作者:Liu,Xin; Fu,Yue; Chen,Zhijie; Liu,Peng; Dong,Guangbin
参考文献:Nature Chemistry 日期:2023 卷标:15(10) 页码:1391-1399]

72135-36-5 = 791642-68-7
反应条件:1.1 Reagents: Iodine,Tripotassium Phosphate Solvents: Acetonitrile; 6 H,100 °C; 100 °C -> Rt1.2 Reagents: Sodium Carbonate,Sodium Persulfate Solvents: Water; Rt
标题:Transition-Metal-Free Decarboxylative Iodination: New Routes For Decarboxylative Oxidative Cross-Couplings
作者:Perry,Gregory J. P.; Quibell,Jacob M.; Panigrahi,Adyasha; Larrosa,Igor
参考文献:Journal Of The American Chemical Society 日期:2017 卷标:139(33) 页码:11527-11536]

59557-91-4 = 791642-68-7
反应条件:1.1 Reagents: Sodium Nitrite,Sulfuric Acid,Potassium Iodide
标题:Synthesis-Guided Structure Revision Of The Sarcodonin,Sarcoviolin,And Hydnellin Natural Product Family
作者:Lin,David W.; Masuda,Takeshi; Biskup,Moritz B.; Nelson,Jonathan D.; Baran,Phil S.
参考文献:Journal Of Organic Chemistry 日期:2011 卷标:76(4) 页码:1013-1030]

59557-91-4 = 791642-68-7
反应条件:1.1 Reagents: P-Toluenesulfonic Acid,Sodium Nitrite,Potassium Iodide
标题:Pyridazine-Derived γ-Secretase Modulators
作者:Wan,Zehong; Hall,Adrian; Jin,Yun; Xiang,Jia-Ning; Yang,Eric; Et Al
参考文献:Bioorganic & Medicinal Chemistry Letters 日期:2011 卷标:21(13) 页码:4016-4019]

59557-91-4 = 791642-68-7 [标题:Reaction Conditions
标题:Synthesis Of C3,C4-Disubstituted Indoles Via The Palladium/norbornene-Catalyzed Ortho-Amination/ipso-Heck Cyclization
作者:Rago,Alexander J.; Dong,Guangbin
参考文献:Organic Letters 日期:2021 卷标:23(9) 页码:3755-3760]

59557-91-4 = 791642-68-7
反应条件:1.1 Reagents: Sodium Nitrite,Sulfuric Acid Solvents: Water; 30 Min,5 - 10 °C1.2 Reagents: Potassium Iodide; 1 H,Rt
标题:The Synthesis And Sar Of 2-Arylsulfanylphenyl-1-Oxyalkylamino Acids As Glyt-1 Inhibitors
作者:Smith,Garrick; Mikkelsen,Gitte; Eskildsen,Jorgen; Bundgaard,Christoffer
参考文献:Bioorganic & Medicinal Chemistry Letters 日期:2006 卷标:16(15) 页码:3981-3984]

2398-37-0 = 791642-68-7 + 466639-53-2
反应条件:1.1 Reagents: N-Iodosuccinimide Catalysts: [1,1,1-Trifluoro-N-[(Trifluoromethyl)Sulfonyl]Methanesulfonamidato-Kn](Triphenyl... Solvents: Dichloromethane,Toluene; 14 H,40 °C
标题:Gold(I)-Catalyzed Iodination Of Arenes
作者:Leboeuf,David; Ciesielski,Jennifer; Frontier,Alison J.
参考文献:Synlett 日期:2014 卷标:25(3) 页码:399-402

📜2-甲氧基-4-硝基乙酰苯胺置于硫酸,铁粉,溶剂黄146,Sodium Nitrite体系中,化学反应生成 4-溴-1-碘-2-甲氧基苯
参考文献:Stereochemistry Of Diphenyls. Xli.1 The Effect Of 4'-Substitution On The Rate Of Racemization Of 2-Nitro-6-Carboxy-2'-Methoxydiphenyl
标题:Stereochemistry Of Diphenyls. Xli.1 The Effect Of 4'-Substitution On The Rate Of Racemization Of 2-Nitro-6-Carboxy-2'-Methoxydiphenyl
摘要:
DOI:10.1021/ja01312A026