CAS: 94569-84-3; 2-Bromo-5-Fluorobenzaldehyde

该化合物是一种有机化合物,其特点是其芳香结构,其特点是苯甲二烯功能组,在苯环上含有溴和氟替代物.具体地说,溴原子位于第二个位置,氟原子位于相对于甲酰组的第五位置.该化合物一般是黄色至浅褐色液体或固体,取决于其纯度和温度.由于存在可参与各种化学反应的正丁二烯功能组,包括核生殖器添加和凝聚反应,因此已知该化合物具有再活动性.溴和氟素等卤素的存在可影响该化合物的再活动性,极度和总体化学行为,从而使其在合成有机化学中有用,特别是在制药和农用化学的开发中.此外,2-Bromo-5-氟乙二苯二烯可能会表现出特定的物理特性,例如沸点和熔点,这些物理特性会受到其分子结构和分子间相互作用的影响.

英文名称2-Bromo-5-Fluorobenzaldehyde
中文名称2-溴-5-氟苯甲醛
IUPAC名称2-bromo-5-fluorobenzaldehyde
其它别名5-氟-2-溴苯甲醛; 2-Bromo-5-Fluorobenzaldhyde
CAS编号94569-84-3
MFCD编号:MFCD00142872
EINECS号:619-047-9
分子式:C7H4BrFO
分子量:203.01
产品CID: 1997206
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: CJUCIKJLMFVWIS-UHFFFAOYSA-N
InChI=1S/C7H4BrFO/c8-7-2-1-6(9)3-5(7)4-10/h1-4H…
计算化学: 氢键受体数1.0氢键供体数0.0可旋转键数1.0

物理性质

熔点51-56°C
沸点225.8°C at 760 mmHg
闪点90.4±21.8 °C
密度1.7±0.1 g/cm3
PSA:17.07
LogP:2.4007
折射率1.585
蒸汽压0.1±0.4 mmHg at 25°C
溶解性Soluble In Methanol.
敏感性空气敏感
外观形态白色至橙色至绿色粉末至块状物
储存条件2-8°C
产品应用该化合物用于合成1位置和5-氟-1,3-二氢-二氟-氢-2,1-苯甲氧基的含丙烯,异丙烯或氯乙烯替代成分的二氢苯乙烷.

MSDS等安全信息

GHS象形图
GHS符号GHS07;
注释: Exclamation mark
危险类别特定目标器官毒性 - 单次接触类别3
皮肤腐蚀/刺激类别2
严重眼刺激类别2
急性毒性类别3(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.
H331 |吸入会中毒.
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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
UN编号NONH for all modes of transport
危险品标志Xi
风险等级Irritant
安全声明26-36/37/39-24/25
危险类别码36/37/38
WGK Germany3

欧盟法规

ECHA物质C&L通报REACH预注册

上下游产品

合成工艺路线路线简述

合成目标产物 2-Bromo-5-Fluorobenzaldehyde 主要起始原料 2-Bromo-5-Fluorobenzyl Alcohol
202865-66-5 = 94569-84-3
反应条件:1.1 Reagents: Manganese Oxide (Mno2) Solvents: Dichloromethane; 2 D,Rt
标题:Preparation Of 2-Amino-3-Arylpropanoic Acid And 2-Amino-3-Heterocyclylpropanoic Acid Derivatives As Tryptophan Hydroxylase Inhibitors For The Treatment Of Cancer
参考文献:World Intellectual Property Organization]

202865-66-5 = 94569-84-3
反应条件:1.1 Reagents: Manganese Oxide (Mno2) Solvents: Dichloromethane; 2 D,Rt
标题:Preparation Of 4-[6-(2,2,2-Trifluoro-1-Phenylethoxy)Pyrimidin-4-Yl]-(S)-Phenylalanine Derivative Tryptophan Hydroxylase Inhibitors For Treating Osteoporosis
参考文献:World Intellectual Property Organization]

202865-66-5 = 94569-84-3
反应条件:1.1 Reagents: 1-Hydroxy-1,2-Benziodoxol-3(1H)-One 1-Oxide; 1 H,Rt
标题:Ibx Works Efficiently Under Solvent-Free Conditions In Ball Milling
作者:Achar,Tapas Kumar; Maiti,Saikat; Mal,Prasenjit
参考文献:Rsc Advances 日期:2014 卷标:4(25) 页码:12834-12839]

202865-66-5 = 94569-84-3
反应条件:1.1 Reagents: Pyridinium Chlorochromate Solvents: Dichloromethane; Rt
标题:Metal-Catalyzed Cycloisomerization Of Enyne Functionalities Via A 1,3-Alkylidene Migration
作者:Lin,Ming-Yuan; Das,Arindam; Liu,Rai-Shung
参考文献:Journal Of The American Chemical Society 日期:2006 卷标:128(29) 页码:9340-9341]

112399-50-5 = 94569-84-3
反应条件:1.1 Reagents: Potassium Carbonate Solvents: Dimethyl Sulfoxide; 8 H,60 °C
标题:Silver-Catalyzed Stereoselective [3+2] Cycloadditions Of Cyclopropyl-Indanimines With Carbonyl Compounds
作者:Hung,Hsiao-Hua; Liao,Yi-Ching; Liu,Rai-Shung
参考文献:Advanced Synthesis & Catalysis 日期:2013 卷标:355(8) 页码:1545-1552]

721882-07-1 = 94569-84-3
反应条件:1.1 Reagents: Phosphoric Tribromide Solvents: Chloroform; 10 Min,0 °C; 45 - 60 Min,Rt1.2 Solvents: Chloroform; 10 - 15 H,0 °C1.3 Reagents: Potassium Carbonate Solvents: Water; Neutralized,0 °C
标题:One-Pot Tandem Amidation,Knoevenagel Condensation,And Palladium-Catalyzed Wacker Type Oxidation/c-O Coupling: Synthesis Of Chromeno-Annulated Imidazopyridines
作者:Pandey,Khima; Rangan,Krishnan; Kumar,Anil
参考文献:Journal Of Organic Chemistry 日期:2018 卷标:83(15) 页码:8026-8035]

202865-66-5 = 94569-84-3
反应条件:1.1 Reagents: Tert-Butyl Hydroperoxide Catalysts: Silver,Copper,Silica Solvents: Toluene,Water; 4 H,120 °C
标题:Synthesis Of Smart Bimetallic Nano-Cu/ag@sio2 For Clean Oxidation Of Alcohols
作者:Saha,Arijit; Payra,Soumen; Banerjee,Subhash
参考文献:New Journal Of Chemistry 日期:2017 卷标:41(22) 页码:13377-13381]

202865-66-5 = 94569-84-3
反应条件:1.1 Reagents: Manganese Oxide (Mno2) Solvents: Dichloromethane; 2 D,Rt
标题:Preparation Of Multicyclic Amino Acid Derivations As Potent And Selective Thp1 Inhibitors For Treating Metastatic Bone Disease
参考文献:World Intellectual Property Organization]

202865-66-5 = 94569-84-3
反应条件:1.1 Reagents: Manganese Oxide (Mno2) Solvents: Dichloromethane; 2 D,Rt
标题:Preparation Of Pyrimidine Derivatives As Tph1 Inhibitors
参考文献:China]

202865-66-5 = 94569-84-3
反应条件:1.1 Reagents: Manganese Oxide (Mno2) Solvents: Dichloromethane; 2 D,Rt
标题:Preparation Of Multicyclic Amino Acid Derivative Tryptophan Hydroxylase Inhibitors And Methods Of Using Them For Affecting Gastrointestinal Transit And Gastric Emptying
参考文献:World Intellectual Property Organization]

202865-66-5 = 94569-84-3
反应条件:1.1 Reagents: Manganese Oxide (Mno2) Solvents: Dichloromethane; 2 D,Rt
标题:Preparation Of 4-[6-(2,2,2-Trifluoro-1-Phenylethoxy)Pyrimidin-4-Yl]-(S)-Phenylalanine Derivatives As Tryptophan Hydroxylase Inhibitors
参考文献:World Intellectual Property Organization]

= 94569-84-3
反应条件:1.1 Reagents: Formaldehyde,P-Toluenesulfonic Acid Solvents: Tetrahydrofuran,Water; 15 Min,100 °C
标题:Selective Ortho-Bromination Of Substituted Benzaldoximes Using Pd-Catalyzed C-H Activation: Application To The Synthesis Of Substituted 2-Bromobenzaldehydes
作者:Dubost,Emmanuelle; Fossey,Christine; Cailly,Thomas; Rault,Sylvain; Fabis,Frederic
参考文献:Journal Of Organic Chemistry 日期:2011 卷标:76(15) 页码:6414-6420]

202865-66-5 = 94569-84-3
反应条件:1.1 Reagents: Triphenylmethanol Catalysts: Iron Chloride (Fecl3); 1 H,55 °C
标题:Fe(Iii)-Catalyzed Trityl Benzyl Ether Formation And Disproportionation Cascade Reactions To Yield Benzaldehydes
作者:Wang,Xiaoyu; Du,Chuan; Shi,Hui; Pang,Yadong; Jin,Shengfei; Et Al
参考文献:Tetrahedron 日期:2015 卷标:71(38) 页码:6744-6748]

202865-66-5 = 94569-84-3
反应条件:1.1 Reagents: Triphenylmethanol Catalysts: [1,1,1-Trifluoro-N-[(Trifluoromethyl)Sulfonyl]Methanesulfonamidato-Kn](Triphenyl...; Rt -> 140 °C; 1 H,140 °C
标题:Process For Synthesis Oxidation Of Benzyl Alcohols With Gold Catalyst
参考文献:China]

= 94569-84-3 [标题:Reaction Conditions
标题:Thermolytic Synthesis Of Naphthalenes Via Intramolecular Cyclocondensation Of O-Phenylallylbenzaldehydes
作者:Chang,Meng-Yang; Hsueh,Nai-Chen
参考文献:Synthesis 日期:2018 卷标:50(17) 页码:3408-3419]

= 94569-84-3 [标题:Reaction Conditions
标题:Diaryl Macrocycles As Modulators Of Protein Kinases And Their Preparation
参考文献:World Intellectual Property Organization]

202865-66-5 = 94569-84-3 + 394-28-5
反应条件:1.1 Reagents: Oxygen Catalysts: Biphenyl,Sodium Bicarbonate,Tetrabutylammonium Chloride,Tempo,Iridium(1+),[4,4′-Bis(1,1-Dimethylethyl)-2,2′-Bipyridine-Kn1,Kn1′]Bis[2-(2-Pyri... Solvents: Dichloromethane,Water; 48 H,Rt
标题:Tempo-Mediated Oxidation Of Primary Alcohols To Aldehydes Under Visible Light And Air
作者:Liu,Dongwang; Zhou,Hongxia; Gu,Xiangyong; Shen,Xiaoqin; Li,Pixu
参考文献:Chinese Journal Of Chemistry 日期:2014 卷标:32(2) 页码:117-122

2-溴-5-氟苯甲酸甲酯置于manganese(Iv) Oxide,Sodium Tetrahydroborate,Lithium Chloride体系中,用四氢呋喃,乙醇,二氯甲烷作为反应溶剂,化学反应 48.17H,反应生成 2-溴-5-氟苯甲醛
参考文献:基于4-苯基-6-(2,2,2-三氟-1-苯基乙氧基) 嘧啶的化合物及其应用方法
标题:基于4-苯基-6-(2,2,2-三氟-1-苯基乙氧基) 嘧啶的化合物及其应用方法
摘要:本发明涉及基于4‑苯基‑6‑(2,2,2‑三氟‑1‑苯基乙氧基)嘧啶的化合物及其应用方法.具体地,本发明公开了式i化合物,以及包含它们的组合物,以及它们用于治疗,预防和/或管理疾病或紊乱的方法:.

海关参考信息

2912110000-甲醛
2912210000-苯甲醛
💡 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

专利号:US-8106031-B2
优先权日:2006-05-02
标题:Hydrolytically-resistant boron-containing therapeutics and methods of use
发明人：LEE VING; PLATTNER JACOB J; BENKOVIC STEPHEN J; BAKER STEPHEN J; MAPLES KIRK R; BELLINGER-KAWAHARA CAROLYN; AKAMA TSUTOMU; ZHANG YONG-KANG; SINGH RAJESHWAR; SAURO VITTORIO A
权利人:LEE VING; PLATTNER JACOB J; BENKOVIC STEPHEN J; BAKER STEPHEN J; MAPLES KIRK R; BELLINGER-KAWAHARA CAROLYN; AKAMA TSUTOMU; ZHANG YONG-KANG; SINGH RAJESHWAR; SAURO VITTORIO A; ANACOR PHARMACEUTICALS INC
摘要:Compositions and methods of use of boron derivatives, including benzoxaboroles, benzazaboroles and benzthiaboroles, as therapeutic agents for treatment of diseases caused by fungi, yeast, bacteria or viruses are disclosed, as well as methods for synthesis of said agents and compositions thereof.

专利号:US-7968752-B2
优先权日:2003-06-16
标题:Hydrolytically-resistant boron-containing therapeutics and methods of use
发明人：LEE VING; PLATTNER JACOB J; BENKOVIC STEPHEN J; BAKER STEPHEN J; MAPLES KIRK R; BELLINGER-KAWAHARA CAROLYN; AKAMA TSUTOMU; ZHANG YONG-KANG; SINGH RAJESHWAR; SAURO VITTORIO A
权利人:ANACOR PHARMACEUTICALS INC
摘要:Compositions and methods of use of borole derivatives, including benzoxaboroles, benzazaboroles and benzthiaboroles, as therapeutic agents for treatment of diseases caused by bacteria or viruses are disclosed, as well as methods for synthesis of said agents and compositions thereof.

专利号:US-11801251-B2
优先权日:2015-11-03
标题 :Selective HDAC8 inhibitors and their uses
发明人：MEYER-ALMES FRANZ-JOSEF; MEYNERS CHRISTIAN; KLEINSCHEK ALEXANDER; HAUS PATRICIA
权利人:HOCHSCHULE DARMSTADT
摘要:The present invention relates to small molecule compounds based on benzopyrimido- or benzoimidazo-thiazin-imine as well as their (synthesis) intermediates and their use as HDAC inhibitors, in particular HDAC8 inhibitors. The present invention also relates to the use of said compounds in the treatment of cancer and as therapeutic agents for eukaryotic parasites and respective methods of treatment.

专利号:CN-115536509-B
优先权日:2022-04-06
标题 :Synthesis method of 2-bromo-4-hydroxybenzaldehyde

专利号:CN-103275085-A
优先权日:2013-05-30
标题 :A kind of quinazolinoquinazolinone compound and its synthesis method and application

专利号:CN-103275085-B
优先权日:2013-05-30
标题 :A kind of quinazolinoquinazolinone compound and its synthesis method and application

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主要参考文献

参考标题:Synthesis Of Phthalan Derivatives Via A Formal Intramolecular 1,3-Insertion Of Rhodium(II) Azavinyl Carbenes Into O Si Bond
作者:Shengguo Duan,Qiaoyi Xiang,Changchang Deng,Yuchen Jie,Huan Luo,Ze-Feng Xu |发布日期:2021.9
摘要:The First Formal Intramolecular 1,3-Insertion Into Osi Bond Of Rhodium(II) Azavinyl Carbene Have Been Developed, And Valuable Phthalan Derivatives Could Be Synthesized Efficiently. In Addition, Various Functional Groups Could Be Introduced To The Product Conveniently In The Assistant Of Tbaf.

合成参考文献

摘要:Sapeta, K.; Kerr, M. A., Science of Synthesis Knowledge Updates, (2011) 1, 18.
摘要:Dong, X.; Liu , H., Science of Synthesis Knowledge Updates, (2019) 3, .
摘要:Sharma, U.; Kumar, R.; Gupta, S. S.; Chandra, D., Science of Synthesis Knowledge Updates, (2022) 2, 361.
摘要:Silva, V. L. M.; Pinto, D. C. G. A.; Santos, C. M. M.; Rocha, D. H. A., Science of Synthesis Knowledge Updates, (2022) 3, 206.
摘要:Silva, V. L. M.; Pinto, D. C. G. A.; Santos, C. M. M.; Rocha, D. H. A., Science of Synthesis Knowledge Updates, (2022) 3, 380.

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CAS: 94569-84-3; 2-Bromo-5-Fluorobenzaldehyde

物理性质

MSDS等安全信息

欧盟法规

上下游产品

合成工艺路线路线简述

海关参考信息

专利信息

其他信息查阅

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品牌试剂参考报价(招募中)

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主要参考文献

合成参考文献

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