CAS: 93-25-4; 2-Methoxyphenylacetic Acid

该化合物是一种芳香的碳酸,其特征是附于一个苯环的甲氧基(-OCH)组,该组还被乙酸酸协会所取代,该组通常看起来像白色的脱白晶体状固体,在乙醇和乙醇等有机溶剂中可溶解,但在水中溶解性有限;它显示出一个熔点,这是其分子结构的特征;其化学配方为CHEUO. 2-甲基苯乙酸,因其在制药和有机合成中的潜在应用而众所周知;甲基氧基和氨基酸功能组的存在有助于其再活动,使其得以参与各种化学反应,包括消化和恐吓;此外,它可能展示生物活动,使其对药用化学具有兴趣;适当的处理和储存由于其化学特性和潜在再活动而必不可少.

英文名称2-Methoxyphenylacetic Acid
中文名称2-甲氧基苯乙酸
IUPAC名称2-(2-methoxyphenyl)acetic acid
其它别名2-甲氧基苯基乙酸; 2甲氧基苯乙酸; 2-Methoxybenzeneacetic Acid; O-Methoxyphenylacetic Acid; 2-Methoxyphenylacetic Acid
CAS编号93-25-4
MFCD编号:MFCD00004321
EINECS号:202-231-4
FDA UNII编号:DWF2D897KB
分子式:C9H10O3
分子量:166.17
产品CID: 1970884
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: IVEWTCACRDEAOB-UHFFFAOYSA-N
InChI=1S/C9H10O3/c1-12-8-5-3-2-4-7(8)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)…
计算化学: 氢键受体数2.0氢键供体数1.0可旋转键数3.0

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
严重眼损伤类别1
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.
H318 |造成严重眼损伤.
防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
危险等级8
UN编号3259.0
危险品标志Xi
风险等级Irritant
包装等级Ⅲ
安全声明26-36-24/25
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

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合成工艺路线路线简述

7417-18-7 = 93-25-4
反应条件:1.1 Catalysts: Tempo Solvents: Acetonitrile,Water1.2 Reagents: Sodium Chlorite1.3 Reagents: Sodium Hypochlorite Solvents: Water1.4 Reagents: Sodium Hydroxide Solvents: Water1.5 Reagents: Sodium Sulfite Solvents: Water1.6 Solvents: Tert-Butyl Methyl Ether1.7 Reagents: Hydrochloric Acid Solvents: Water
标题:Oxidation Of Primary Alcohols To Carboxylic Acids With Sodium Chlorite Catalyzed By Tempo And Bleach
作者:Zhao,Mangzhu; Li,Jing; Mano,Eiichi; Song,Zhiguo; Tschaen,David M.; Et Al
参考文献:Journal Of Organic Chemistry 日期:1999 卷标:64(7) 页码:2564-2566]

7417-18-7 = 93-25-4
反应条件:1.1 Reagents: Periodic Acid Catalysts: Chromium Trioxide Solvents: Acetonitrile,Water1.2 Reagents: Disodium Phosphate Solvents: Water
标题:Oxidation Process Of Alcohols Using Periodic Acid And Chromium Catalyst
参考文献:World Intellectual Property Organization]

123902-10-3 = 93-25-4
反应条件:1.1 Reagents: Hydrochloric Acid Solvents: 1,4-Dioxane,Water; 71 H,Reflux
标题:An Efficient Method For One-Carbon Elongation Of Aryl Aldehydes Via Their Dibromoalkene Derivatives
作者:Huh,Dal Ho; Jeong,Ji Sang; Lee,Hee Bong; Ryu,Hoejin; Kim,Young Gyu
参考文献:Tetrahedron 日期:2002 卷标:58(50) 页码:9925-9932]

7035-02-1 = 93-25-4
反应条件:1.1 Reagents: Sodium Carbonate,Dicyclohexylcarbodiimide Catalysts: Triphenylphosphine,Palladium Diacetate Solvents: Acetonitrile; 20 H,60 °C
标题:Palladium Catalyzed Carbonylation Of Benzyl Chlorides: Additive-Controlled Divergent Synthesis Of Benzyl Arylacetates And Arylacetic Acids
作者:Peng,Jin-Bao; Wang,Wei-Feng; Wu,Fu-Peng; Ying,Jun; Qi,Xinxin; Et Al
参考文献:Journal Of Catalysis 日期:2018 卷标:368 页码:275-278]

53313-93-2 = 93-25-4
反应条件:1.1 Reagents: Hydrochloric Acid,Stannous Chloride,Hydrogen Iodide Solvents: Acetic Acid
标题:Preparation Of ο-Hydroxyphenylacetic Acid
作者:Levine,Joseph; Eble,T. E.; Fischbach,Henry
参考文献:Journal Of The American Chemical Society 日期:1948 卷标:70]

6056-23-1 = 93-25-4
反应条件:1.1 Reagents: Sodium Hydroxide Solvents: Water; Rt -> 50 °C; 2 H,50 °C; 50 °C -> Rt1.2 Reagents: Hydrochloric Acid Solvents: Water; Ph 1,Rt
标题:Method For Synthesizing Benzofuranone From O-Cresol
参考文献:China]

60779-18-2 = 93-25-4
反应条件:1.1 Reagents: Potassium Hydroxide Solvents: Methanol,Water; 20 Min,90 °C
标题:Palladium-Catalyzed α-Arylation Of Dimethyl Malonate And Ethyl Cyanoacetate With O-Alkoxybromobenzenes For The Synthesis Of Phenylacetic Acid,Esters And Phenylacetonitriles
作者:Civicos,Jose F.; Costa,Paulo R. R.; Domingos,Jorge L. O.
参考文献:Synopen 日期:2017 卷标:1(1) 页码:0091-0096]

578-58-5 = 93-25-4
反应条件:1.1 Reagents: Butyllithium Solvents: Tetrahydrofuran; -78 °C; 5 Min,-78 °C1.2 Reagents: 2,2,6,6-Tetramethylpiperidine,Potassium Tert-Butoxide Solvents: Tetrahydrofuran; 15 Min,-78 °C1.3 -78 °C -> Rt1.4 Reagents: Hydrochloric Acid Solvents: Water; Acidified,Rt1.5 Reagents: Hydrochloric Acid Solvents: Water; Overnight,Reflux
标题:Controlled Anion Migrations With A Mixed Metal Li/k-Tmp Amide: General Application To Benzylic Metalations
作者:Fleming,Patricia; O'Shea,Donal F.
参考文献:Journal Of The American Chemical Society 日期:2011 卷标:133(6) 页码:1698-1701]

7417-18-7 = 93-25-4
反应条件:1.1 Catalysts: Tempo Solvents: Acetonitrile; Ph 6.7,Rt1.2 Reagents: Sodium Chlorite Catalysts: Sodium Hypochlorite Solvents: Water; Rt; Rt -> 35 °C; 8 - 12 H,35 °C1.3 Reagents: Sodium Hydroxide Solvents: Water; Ph 8,Rt1.4 Reagents: Hydrochloric Acid Solvents: Tert-Butyl Methyl Ether,Water; Ph 3 - 4,Rt
标题:Oxidation Of Primary Alcohols To Carboxylic Acids With Sodium Chlorite Catalyzed By Tempo And Bleach: 4-Methoxyphenylacetic Acid
作者:Zhao,Matthew M.; Li,Jing; Mano,Eiichi; Song,Zhiguo J.; Tschaen,David M.
参考文献:Organic Syntheses 日期:2005 卷标:81 页码:195-203]

7417-18-7 = 93-25-4
反应条件:1.1 Catalysts: Tempo Solvents: Acetonitrile,Water1.2 Reagents: Sodium Chlorite Solvents: Water1.3 Catalysts: Sodium Hypochlorite Solvents: Water1.4 Reagents: Sodium Hydroxide Solvents: Water
标题:Oxidation Of Primary Alcohols In The Presence Of Tempo
参考文献:World Intellectual Property Organization]

7417-18-7 = 93-25-4
反应条件:1.1 Reagents: Periodic Acid (H5Io6) Catalysts: Chromium Trioxide Solvents: Acetonitrile,Water
标题:A Novel Chromium Trioxide Catalyzed Oxidation Of Primary Alcohols To The Carboxylic Acids
作者:Zhao,Mangzhu; Li,Jing; Song,Zhiguo; Desmond,Richard; Tschaen,David M.; Et Al
参考文献:Tetrahedron Letters 日期:1998 卷标:39(30) 页码:5323-5326]

7035-03-2 = 93-25-4
反应条件:1.1 Reagents: Acetic Acid,Sulfuric Acid; 1 - 1.5 H,Rt -> 100 °C; 12 H,125 - 130 °C
标题:Process For Preparation Of 8-Methoxy-3,4-Dihydro-1H-2-Naphthalenone
参考文献:China]

614-75-5 = 93-25-4
反应条件:1.1 Reagents: Sodium Hydroxide Solvents: Water; 50 °C; 10 H,50 °C1.2 Reagents: Hydrochloric Acid Solvents: Water; Ph 2 - 3
标题:Research On Synthesis Process Of Methoxyphenamine Hydrochloride
作者:Yao,Yi; Liu,Yanbin; Tang,Qian; Zhong,Weihui
参考文献:Huagong Shengchan Yu Jishu 日期:2012 卷标:19(1) 页码:7-9]

28066-57-1 = 93-25-4
反应条件:1.1 Reagents: Ozone Solvents: Dichloromethane1.2 Reagents: Hydrogen Peroxide Solvents: Acetic Acid
标题:Preparation Of Phenylacetic Acid Derivatives And Intermediate Products.
参考文献:European Patent Organization]

53313-93-2 = 93-25-4
反应条件:1.1 Reagents: Hydrochloric Acid,Stannous Chloride,Hydrogen Iodide Solvents: Acetic Acid,Water
标题:Studies On Oxygen Heterocycles. Part 1. Acid Catalyzed And Photochemical Reactions Of Some Aryl Diazo Ketones
作者:Ghosh,Somnath; Datta,Indira; Chakraborty,Rupak; Das,Tapas Kumar; Sengupta,Judhajit; Et Al
参考文献:Tetrahedron 日期:1989 卷标:45(5) 页码:1441-6]

90585-32-3 = 93-25-4
反应条件:1.1 Reagents: Butyllithium Solvents: Tetrahydrofuran,Hexane; 0 °C; 1.5 H,0 °C1.2 Reagents: Isopropoxy 4,4,5,5-Tetramethyl-1,3,2-Dioxaborolane; 2 H,0 °C1.3 Reagents: Hydrochloric Acid Solvents: 1,4-Dioxane; 0 °C -> Rt; 1 H,Rt1.4 Reagents: Potassium Peroxymonosulfate Sulfate (2Khso5.Khso4.K2So4) Solvents: Acetone,Water; 12 H,50 °C
标题:Synthesis Of Carboxylic Acids,Esters,And Amides From 1,1-Dibromoalkenes Via Oxidation Of Alkynyl Boronate Intermediates
作者:Tao,Lei; Yang,Wen; Zhao,Wanxiang
参考文献:Chemistryselect 日期:2021 卷标:6(33) 页码:8532-8536]

90585-32-3 = 93-25-4
反应条件:1.1 Reagents: Butyllithium Solvents: Tetrahydrofuran; 0 °C; 1.5 H,0 °C1.2 Reagents: Isopropoxy 4,4,5,5-Tetramethyl-1,3,2-Dioxaborolane; 0 °C; 2 H,0 °C1.3 Reagents: Hydrochloric Acid Solvents: 1,4-Dioxane; 1 H,0 °C -> Rt1.4 Reagents: Potassium Peroxymonosulfate Solvents: Acetone,Water; 12 H,50 °C
标题:Method For Preparing Carboxylic Acid From 1,1-Dibromoalkene By One-Pot Method
参考文献:China]

27946-59-4 = 93-25-4
反应条件:1.1 Reagents: Manganese Catalysts: 2,9-Dibutyl-4,7-Dimethyl-1,10-Phenanthroline,Dibromo[1,1′-(Oxy-Ko)Bis[2-(Methoxy-Ko)Ethane]]Nickel Solvents: Dimethylformamide; 1 Atm,Rt; Rt -> 90 °C; 72 H,90 °C; 90 °C -> Rt1.2 Reagents: Hydrochloric Acid Solvents: Water; Rt
标题:Nickel-Catalyzed Carboxylation Of Benzylic C-N Bonds With Co2
作者:Moragas,Toni; Gaydou,Morgane; Martin,Ruben
参考文献:Angewandte Chemie 日期:2016 卷标:55(16) 页码:5053-5057]

612-15-7 = 93-25-4
反应条件:1.1 Catalysts: Iodine Solvents: 1,2-Dimethoxyethane,Water; 1 Min,Rt1.2 Reagents: Potassium Peroxymonosulfate Sulfate (2Khso5.Khso4.K2So4); Rt; 3.5 H,Rt
标题:Metal-Free,Catalytic Regioselective Oxidative Conversion Of Vinylarenes: A Mild Approach To Phenylacetic Acid Derivatives
作者:Kodumuri,Srujana; Peraka,Swamy; Mameda,Naresh; Chevella,Durgaiah; Banothu,Rammurthy; Et Al
参考文献:Rsc Advances 日期:2016 卷标:6(8) 页码:6719-6723]

82204-44-2 = 93-25-4
反应条件:1.1 Reagents: Hydrogen Peroxide Solvents: Water
标题:Intermolecular Acylation. Iii. The Preparation And Ring Closure Of The α-(Methoxyphenyl)Glutaric Acids
作者:Hey,D. H.; Nagdy,K. A.
参考文献:Journal Of The Chemical Society 日期:1953 卷标:1894 页码:1894-9

2-甲基苯甲醚置于copper (II)-Fluoride,二叔丁基过氧化物,4,5-双二苯基膦-9,9-二甲基氧杂蒽,Sodium Hydroxide体系中,用水作为反应溶剂,50.0~120.0 °C,5.07 Mpa 条件下,反应 18.0H,反应生成 2-甲氧基苯乙酸
参考文献:一种苯并呋喃酮的合成方法
标题:一种苯并呋喃酮的合成方法
摘要:本发明提出了一种苯并呋喃酮的合成方法,通过以相对易得的邻甲酚作为起始原料,经四步反应制得目标产物苯并呋喃酮,整个制备过程条件温和,收率高,易操作,且环境污染小,适合大规模工业化生产.

海关参考信息

2902600000-乙苯
2912110000-甲醛
2912120000-乙醛
2915110000-甲酸
💡 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-9643915-B2
优先权日:2013-03-15
标题:Methods for the synthesis of sphingomyelins and dihydrosphingomyelins
发明人：ONICIU DANIELA CARMEN; HECKHOFF STEFAN; OSWALD BENOIT; REBMANN PETER; PEER ANDREAS; GONZALEZ MIGUEL; SAUTER PATRIK
权利人:CERENIS THERAPEUTICS HOLDING SA
摘要:The present invention includes methods for the synthesis of sphingomyelins and dihydrosphingomyelins. The present invention also includes methods for the synthesis of sphingosines and dihydrosphingosines. The present invention further includes methods for the synthesis of ceramides and dihydroceramides.

专利号:US-7612210-B2
优先权日:2005-12-05
标题:Process for selective synthesis of enantiomers of substituted 1-(2-amino-1-phenyl-ethyl)-cyclohexanols
发明人：MAHANEY PAIGE ERIN; ANTANE MADELENE MIYOKO; SUN JERRY SHUNNENG
权利人:WYETH CORP
摘要:A process for the enantioselective synthesis of an (S)- or (R)-1-[2-dimethylamino)-1-(methoxyphenyl)ethyl]cyclohexanol and analogues or salt thereof are described. The method involves the steps of (a) reacting an (S) or (R) 4-benzyloxazolidinone with a mixed anhydride of a methyoxyphenylacetic acid under conditions which form a oxazolidinone, (4S)- or (4R)-4-benzyl-3-[methyoxyphenyl]acetyl]-oxazolidin-2-one, (b) treating the (4S)- or (4R)-4-benzyl-3-[(methoxyphenyl)acetyl]-1,3-oxazolidin-2-one with an aprotic amine base and titanium chloride in a chlorinated solvent under conditions which permit formation of the corresponding anion, (c) mixing the corresponding anion with titanium chloride and cylcohexanone under conditions which permit an aldol reaction to form the corresponding (4S)- or (4R)-4-benzyl-3-[(2R)-2-(1-hydroxycyclohexyl)-2-(methoxyphenyl)acetyl]-1,3-oxazolidin-2-one,(d) hydrolyzing the (4S)â€” or (4R)-4-benzyl-3-[(2R)-2-(1-hydroxycyclohexyl)-2-(methoxyphenyl)acetyl]-1,3-oxazolidin-2-one to form a chiral acid (2S or 2R)-(1-hydroxycyclohexyl)-methoxyphenyl)acetic acid, (e) coupling the chiral phenylacid to a secondary amine to form an amide, and (f) reducing the amide to form an (S) or (R) 1[2-dimethylamino)-1-(methoxyphenyl)ethyl]cyclohexanol or a salt thereof.

专利号:US-12391691-B2
优先权日:2018-11-16
标题:Synthesis of key intermediate of KRAS G12C inhibitor compound
发明人：PARSONS ANDREW THOMAS; COCHRAN BRIAN MCNEIL; POWAZINIK IV WILLIAM; CAPORINI MARC ANTHONY
权利人:AMGEN INC
摘要:The present invention relates to an improved, efficient, scalable process to prepare intermediate compounds, such as compound 5M, having the structure n nuseful for the synthesis of compounds that target KRAS G12C mutations, such as

专利号:US-7109377-B2
优先权日:1996-10-16
标题:Synthesis of combinatorial libraries of compounds reminiscent of natural products
发明人：SCHREIBER STUART L; SHAIR MATTHEW D; TAN DEREK S; FOLEY MICHAEL A; STOCKWELL BRENT R
权利人:HARVARD COLLEGE
摘要:The present invention provides complex compounds reminiscent of natural products and libraries thereof, as well as methods for their production. The inventive compounds and libraries of compounds are reminiscent of natural products in that they contain one or more stereocenters, and a high density and diversity of functionality. In general, the inventive libraries are synthesized from diversifiable scaffold structures, which are synthesized from readily available or easily synthesizable template structures. In certain embodiments, the inventive compounds and libraries are generated from diversifiable scaffolds synthesized from a shikimic acid based epoxyol template. In other embodiments, the inventive compounds and libraries are generated from diversifiable scaffolds synthesized from the pyridine-based template isonicotinamide. The present invention also provides a novel ortho-nitrobenzyl photolinker and a method for its synthesis. Furthermore, the present invention provides methods and kits for determining one or more biological activities of members of the inventive libraries. Additionally, the present invention provides pharmaceutical compositions containing one or more library members.

专利号:US-7189864-B2
优先权日:1990-11-19
标题:Method of preparing intermediates useful in synthesis of retroviral protease inhibitors
发明人：NG JOHN S; PRZYBYLA CLAIRE A; MUELLER RICHARD A; VAZQUEZ MICHAEL L; GETMAN DANIEL P
权利人:SEARLE & CO
摘要:A synthesis is described for intermediates which are readily amenable to the large scale preparation of hydroxyethylurea-based chiral HIV protease inhibitors. The method includes forming a diastereoselective epoxide from a chiral alpha amino aldehyde.

专利号:US-6022996-A
优先权日:1990-11-19
标题 :Method for making intermediates useful in synthesis of retroviral protease inhibitors
发明人：NG JOHN S; PRZYBYLA CLAIRE A; MUELLER RICHARD A; VAZQUEZ MICHAEL L; GETMAN DANIEL P
权利人:SEARLE & CO
摘要:A synthesis is described for intermediates which are readily amenable to the large scale preparation of hydroxyethylurea-based chiral HIV protease inhibitors. The method includes forming a diastereoselective epoxide from a chiral alpha amino aldehyde.

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主要参考文献

参考标题:Directed Remote Lateral Metalation: Highly Substituted 2-Naphthols And Binols By In Situ Generation Of A Directing Group
作者:Jignesh J. Patel,Marju Laars,Wei Gan,Johnathan Board,Matthew O. Kitching,Victor Snieckus |发布日期:2018.7.20
摘要:General Synthesis Of Highly Substituted 2‐naphthols Based On A New Carbanionic Reaction Sequence Is Demonstrated. The Reaction Exploits The Dual Nature Of Lithium Bases Consisting Of Consecutive Ring Opening Of Readily Available Coumarins With Either Linet2 Or Linipr2 Into Z‐cinnamamides, Thus Generating A Directing Group In Situ And Allowing, By Conformational Freedom, A Lateral Directed Remote Metalation

合成参考文献

摘要:Zhang, M.; Su, W., Science of Synthesis: Catalytic Transformations via CH Activation, (2015) 1, 96.
参考文献:10.1021/jf8002224
摘要:Weitkamp P, Weber N, Vosmann K. Lipophilic (hydroxy)phenylacetates by solvent-free lipase-catalyzed esterification and transesterification in vacuo. J Agric Food Chem. 2008 Jul 09;56(13):5083–90. doi: 10.1021/jf8002224.

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CAS: 93-25-4; 2-Methoxyphenylacetic Acid

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