CAS: 831-82-3; 4-Phenoxyphenol

该化合物是一种有机化合物,其特征是酚结构,由酚组组成,由苯氧组组成,该化合物一般为白色至浅黄色固体,以有机溶剂中中中溶性为名,但水溶性较少,其特性表现为微弱酸,如可参与氢结合的氢氧(-OH)组的存在.4-苯氧酚经常用于各种用途,包括作为合成制药,农用化学品的一个中间体,以及某些制剂的稳定剂.此外,还研究了该化合物的潜在抗氧化性.安全考虑包括谨慎处理该物质,因为它可能造成皮肤和眼刺激.

英文名称4-Phenoxyphenol
中文名称4-苯氧基苯酚
IUPAC名称4-phenoxyphenol
其它别名4-羟基二苯醚; 4羟基二苯醚; P-Phenoxyphenol; 4-Hydroxydiphenyl Ether; 4-Phenoxyphenol
CAS编号831-82-3
MFCD编号:MFCD00002331
EINECS号:212-611-1
FDA UNII编号:D83R742GJR
分子式:C12H10O2
分子量:186.21
产品CID: 1820760
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: ZSBDGXGICLIJGD-UHFFFAOYSA-N
InChI=1S/C12H10O2/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9,13H…
计算化学: 氢键受体数2.0氢键供体数1.0可旋转键数2.0

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(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
皮肤致敏类别1
严重眼刺激类别2A
急性毒性类别4(吸入)
急性毒性类别4(经皮)
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.
H317 |可能引起皮肤过敏反应.
H332 |吸入有害.
H312 |皮肤接触有害.
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
危险类别码36/37/38
WGK Germany3

欧盟法规

REACH注册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 4-Phenoxyphenol 主要起始原料 1,4-Benzoquinone And Phenylboronic Acid
51067-38-0 = 831-82-3
反应条件:1.1 Reagents: Triethylamine,Oxygen Solvents: Ethanol; 12 - 24 H,Rt
标题:Red Light-Induced Highly Efficient Aerobic Oxidation Of Organoboron Compounds Using Spinach As A Photocatalyst
作者:Yan,Peng; Et Al
参考文献:Green Chemistry 日期:2022 卷标:24(23) 页码:9263-9268]

= 831-82-3
反应条件:1.1 Reagents: Potassium Hydroxide Solvents: Toluene; Rt -> 120 °C; 0.5 H,120 °C1.2 Catalysts: Cuprous Chloride; 120 °C -> 180 °C1.3 180 °C; 9 H,180 °C1.4 Reagents: Hydrochloric Acid Solvents: Water; Ph 3
标题:Study On Synthesis Of Pyriproxyfen
作者:He,Xi-Hui; Et Al
参考文献:Xihua Daxue Xuebao 日期:2007 卷标:26(4) 页码:34-35]

98-80-6 = 831-82-3
反应条件:1.1 Catalysts: Copper Iron Oxide (Cufe2O4) Solvents: Methanol; 24 H,25 °C
标题:Solvent-Switchable Regioselective 1,2- Or 1,6-Addition Of Quinones With Boronic Acids
作者:Xia,Qi; Et Al
参考文献:Chemical Communications (Cambridge 日期:2023 卷标:59(54) 页码:8416-8419]

1655-69-2 = 831-82-3
反应条件:1.1 Reagents: 1-Decanethiol,Hexamethyldisilazane Catalysts: N′′′-[p,P-Bis(Dimethylamino)-N-(1,1-Dimethylethyl)Phosphinimyl]-N,N,N′,N′,N′′,N′... Solvents: Tetrahydrofuran,Hexane; 3 H,100 °C1.2 Reagents: Potassium Carbonate Solvents: Methanol; 0 °C; 30 Min,Rt
标题:Organic Superbase T-Bu-P4-Catalyzed Demethylations Of Methoxyarenes
作者:Shigeno,Masanori; Et Al
参考文献:Organic Chemistry Frontiers 日期:2022 卷标:9(14) 页码:3656-3663]

836-07-7 = 831-82-3
反应条件:1.1 Reagents: Hydrogen Iodide Solvents: Acetic Acid,Water
标题:Thyroxine Analogs. Xii. Deiodination Of Iodophenyl Phenyl Ethers With Hydriodic Acid
作者:Jorgensen,Eugene C.; Et Al
参考文献:Journal Of Organic Chemistry 日期:1964 卷标:29(11) 页码:3396-8]

67-36-7 = 831-82-3
反应条件:1.1 Reagents: M-Chloroperbenzoic Acid Solvents: Chloroform; 1 - 3 H,Rt
标题:Design,Synthesis And Insecticidal Evaluation Of Aryloxy Dihaloropropene Derivatives
作者:Yang,Ji-Chun; Et Al
参考文献:Bioorganic & Medicinal Chemistry 日期:2016 卷标:24(3) 页码:383-390]

67-36-7 = 831-82-3
反应条件:1.1 Reagents: M-Chloroperbenzoic Acid Solvents: Chloroform; Overnight,Rt1.2 Reagents: Hydrochloric Acid Solvents: Methanol,Water; 3 H,Rt1.3 Reagents: Sodium Bicarbonate Solvents: Water; Neutralized
标题:Palladium-Mediated Site-Selective C-H Radio-Iodination
作者:Dubost,Emmanuelle; Et Al
参考文献:Organic Letters 日期:2018 卷标:20(19) 页码:6302-6305]

= 831-82-3
反应条件:1.1 Reagents: Acetic Acid,Sodium Borohydride Solvents: Ethanol
标题:Iodothyronine Deiodinase Mimics. Deiodination Of O,O'-Diiodophenols By Selenium And Tellurium Reagents
作者:Vasil'Ev,Andrei A.; Et Al
参考文献:Journal Of Organic Chemistry 日期:1998 卷标:63(12) 页码:3911-3917]

= 831-82-3
反应条件:1.1 Reagents: Potassium Carbonate Catalysts: Cuprous Iodide
标题:The Synthesis Of N-(4-Phenoxyphenoxyethyl)-O-Ethylcarbamate (Fenoxycarb)
作者:Kvartskhava,G.; Et Al
参考文献:Izvestiya Akademii Nauk Gruzii 日期:2000 卷标:26(1-2) 页码:83-87]

= 831-82-3
反应条件:1.1 Catalysts: Zinc Solvents: Dimethylformamide; 3.5 Min
标题:Zinc-Catalyzed Williamson Ether Synthesis In The Absence Of Base
作者:Paul,Satya; Et Al
参考文献:Tetrahedron Letters 日期:2004 卷标:45(48) 页码:8825-8829]

101-55-3 = 831-82-3
反应条件:1.1 Reagents: Cesium Carbonate,Boric Acid (H3Bo3) Catalysts: Palladium Diacetate,[3,6-Dimethoxy-2′,4′,6′-Tris(1-Methylethyl)[1,1′-Biphenyl]-2-Yl]Bis(1,1-Dimethyl... Solvents: N-Methyl-2-Pyrrolidone; 24 H,80 °C; 80 °C -> Rt1.2 Reagents: Hydrochloric Acid Solvents: Water; Rt
标题:Palladium-Catalyzed Hydroxylation Of Aryl Halides With Boric Acid
作者:Song,Zhi-Qiang; Et Al
参考文献:Organic Letters 日期:2020 卷标:22(21) 页码:8470-8474]

51067-38-0 = 831-82-3
反应条件:1.1 Reagents: Diisopropylethylamine,Oxygen Catalysts: Rhodium,Bis[μ-(Acetato-Ko:Ko′)]Bis(Acetato-Ko)Bis(2,2′-Bipyridine-Kn1,Kn1′)Di-,... Solvents: Dimethylformamide; 18 H,1 Atm,Rt
标题:Bimetallic Photoredox Catalysis: Visible Light-Promoted Aerobic Hydroxylation Of Arylboronic Acids With A Dirhodium(Ii) Catalyst
作者:Yang,Hsiang-Ming; Et Al
参考文献:Journal Of Organic Chemistry 日期:2020 卷标:85(4) 页码:2040-2047]

51067-38-0 = 831-82-3
反应条件:1.1 Reagents: Hydrogen Peroxide Catalysts: Graphene (Oxide) Solvents: Water; Rt; 5 Min,Rt
标题:Graphene Oxide As A Carbocatalyst For Sustainable Ipso-Hydroxylation Of Arylboronic Acids: A Simple And Straightforward Strategy To Access Phenols
作者:Karthik,Murugan; Et Al
参考文献:Acs Sustainable Chemistry & Engineering 日期:2019 卷标:7(9) 页码:9028-9034]

80202-05-7 = 831-82-3
反应条件:1.1 Reagents: Sodium Hydroxide Solvents: Water; Reflux; Cooled1.2 Reagents: Hydrochloric Acid Solvents: Water; Ph 2 - 3
标题:Improvement On Synthesis Of 4-Phenoxyphenol
作者:Gao,Yong-Hong; Et Al
参考文献:Huaxue Shijie 日期:2007 卷标:48(7) 页码:418-420]

591-50-4 = 831-82-3
反应条件:1.1 Reagents: Potassium Carbonate Catalysts: 2294849-98-0 (Graphene Oxide Supported) Solvents: Dimethylformamide; 24 H,100 °C
标题:A New Strategy To Design A Graphene Oxide Supported Palladium Complex As A New Heterogeneous Nanocatalyst And Application In Carbon-Carbon And Carbon-Heteroatom Cross-Coupling Reactions
作者:Bahrami,Kiumars; Et Al
参考文献:Applied Organometallic Chemistry 日期:2019 卷标:33(4)]

591-50-4 = 831-82-3
反应条件:1.1 Reagents: Sodium Hydroxide Catalysts: Cobalt Chloride (Cocl2) (Complexes With Ethephon,Amca-Mil53(Al),Amino Guanidine Nitrate,Supp...); 9 H,90 °C1.2 Solvents: Ethyl Acetate
标题:Coii Immobilized On Aminated Magnetic-Based Metal-Organic Framework: An Efficient Heterogeneous Nanostructured Catalyst For The C-O Cross-Coupling Reaction In Solvent-Free Conditions
作者:Mohammadinezhad,Arezou; Et Al
参考文献:Catalysis Letters 日期:2020 卷标:150(2) 页码:332-352]

1655-69-2 = 831-82-3
反应条件:1.1 Catalysts: Sodium Bis(Trimethylsilyl)Amide Solvents: 1,3-Dimethyl-2-Imidazolidinone,Tetrahydrofuran; 185 °C
标题:Sodium Hexamethyldisilazide
作者:Watson,Brett T.; Et Al
参考文献:E-Eros Encyclopedia Of Reagents For Organic Synthesis 日期:2001]

= 831-82-3
反应条件:1.1 Reagents: Trifluoromethanesulfonic Acid Solvents: Dichloromethane; 1 H,25 °C1.2 Reagents: Potassium Carbonate Solvents: Methanol; 25 °C1.3 Reagents: Hydrochloric Acid Solvents: Water; Ph 3 - 5
标题:Simple And Practical Conversion Of Benzoic Acids To Phenols At Room Temperature
作者:Xiong,Wenzhang; Et Al
参考文献:Journal Of The American Chemical Society 日期:2022 卷标:144(34) 页码:15894-15902]

836-07-7 = 831-82-3
反应条件:1.1 Reagents: Hydrogen Iodide Solvents: Acetic Acid,Water
标题:Thyroxine Analogs. Iv. Synthesis Of Aliphatic And Alicyclic Ethers Of 3,5-Diiodo-D-Tyrosine
作者:Jorgensen,Eugene C.; Et Al
参考文献:Journal Of Organic Chemistry 日期:1961 卷标:26 页码:894-900]

67-36-7 = 831-82-3
反应条件:1.1 Reagents: M-Chloroperbenzoic Acid Solvents: Chloroform1.2 Reagents: Hydrochloric Acid Solvents: Methanol
标题:A Convenient Method For The Preparation Of 4-Aryloxyphenols
作者:Yeager,Gary W.; Et Al
参考文献:Synthesis 日期:1991 卷标:(1) 页码:63-8]

= 831-82-3
反应条件:1.1 Catalysts: Zinc Solvents: Dimethylformamide; 2.5 Min
标题:Zinc-Catalyzed Williamson Ether Synthesis In The Absence Of Base
作者:Paul,Satya; Et Al
参考文献:Tetrahedron Letters 日期:2004 卷标:45(48) 页码:8825-8829]

= 831-82-3
反应条件:1.1 Reagents: Potassium Carbonate Catalysts: Iron Oxide (Fe3O4); 48 H,130 °C
标题:Catalytic Synthesis Of Diaryl Ethers With Magnetically Recoverable Fe3O4 Nanoparticles Under Solvent-Free And Ligand-Free Conditions
作者:Feng,Cuilan; Et Al
参考文献:Yingyong Huaxue 日期:2014 卷标:31(5) 页码:536-540]

= 831-82-3 [标题:Reaction Conditions
标题:The Role Of Stereoelectronic Factors In The Oxidation Of Phenols
作者:Armstrong,David R.; Et Al
参考文献:Tetrahedron Letters 日期:1983 卷标:24(10) 页码:1071-4]

= 831-82-3 [标题:Reaction Conditions
标题:Inorganic And Organic Byproducts Of The Reactions Between Chlorite,Activated Carbon,And Phenolic Compounds
作者:Karpel Vel Leitner,Nathalie; Et Al
参考文献:Environmental Science And Technology 日期:1994 卷标:28(2) 页码:222-30]

7005-72-3 = 831-82-3
反应条件:1.1 Reagents: Potassium Carbonate Catalysts: Trans-Di(μ-Acetato)Bis[o-(Di-O-Tolylphosphino)Benzyl]Dipalladium,Bis(1,1-Dimethylethyl)[2′,4′,6′-Tris(1-Methylethyl)[1,1′-Biphenyl]-2-Yl]Phosphin... Solvents: Dimethylformamide,Water; 30 Min,115 °C
标题:Efficient Microwave-Assisted Pd-Catalyzed Hydroxylation Of Aryl Chlorides In The Presence Of Carbonate
作者:Yu,Chao-Wu; Et Al
参考文献:Organic Letters 日期:2012 卷标:14(14) 页码:3688-3691]

139-59-3 = 831-82-3
反应条件:1.1 Reagents: Acetic Acid,Sodium Nitrite,Hydrochloric Acid,Tetrafluoroboric Acid Solvents: Ethanol,Water
标题:A Synthesis Of Dl-Thyronine Via 4-Chloromethyl-4'-Nitrodiphenyl Ether
作者:Southwick,Philip L.; Et Al
参考文献:Journal Of The American Chemical Society 日期:1953 卷标:75 页码:5877-80

一氯化苯醚置于trans-Di(μ-Acetato)Bis[o-(Di-O-Tolyl-Phosphino)Benzyl]Dipalladium(II),C29H45Pt,Potassium Carbonate体系中,用水,N,N-二甲基甲酰胺作为反应溶剂,化学反应 0.5H,以67%的收率获得产物4-苯氧基苯酚
参考文献:Efficient Microwave-Assisted Pd-Catalyzed Hydroxylation Of Aryl Chlorides In The Presence Of Carbonate
标题:Efficient Microwave-Assisted Pd-Catalyzed Hydroxylation Of Aryl Chlorides In The Presence Of Carbonate
摘要:An Efficient Microwave-Assisted,Palladium-Catalyzed Hydroxylation Of Aryl Chlorides In The Presence Of A Weak Base Carbonate Was Developed,Which Rapidly Converts Aryl And Heteroaryl Chlorides To Phenols,And Can Be Used When The Aryl Chloride Is Functionalized With A Ketone,Aldehyde,Ester,Nitrile,Or Amide.
DOI:10.1021/ol301523Q

海关参考信息

2908199090-其他酚的卤化衍生物
2908999090-其他酚的硝化衍生物
2918290000-其他含酚基羧酸
2905199090-其他饱和一元醇
💡 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:WO-9847870-A1
优先权日:1997-04-24
标题:Process for the synthesis of 4-[6-(hexylcarbamoyloxy) hexylcarbamoyloxy]-piperidine-1- carboxylic acid 4-phenoxyphenyl ester
发明人：JIRKOVSKY IVO
权利人:AMERICAN HOME PROD
摘要:This invention is concerned with a new and improved process for the large scale production of 4-[6-(hexylcarbamoyloxy)hexylcarbamoyloxy]-piperidine-1-carboxylic acid 4-phenoxyphenyl ester, disclosed in European Patent Application 0 635 501 A1, published January 25, 1995, a compound that inhibits cholesterol ester hydrolase (CEH) and acylcoenzyme A cholesterol acyltransferase (ACAT). In the invention process, 1-benzyl-4-hydroxypiperidine or 1-methyl-4-hydroxypiperidine is reacted with a carbonylating reagent such as carbonyldiimidazole (CDI) and 6-aminohexanol forming the intermediate 1-benzyl (or methyl)-4-(6-hydroxyhexylcarbamoyloxy)piperidine. Reaction of this intermediate with CDI and hexylamine gives the corresponding 1-benzyl (or methyl)-4-[6-(hexylcarbamoyloxy)-hexylcarbymoyloxy]piperidine. The N-benzyl or methyl group is concomitantly removed and replaced with the 4-phenoxyphenyloxycarbonyl group using 4-phenoxyphenyl chloroformate. The process can be carried out from starting material to final product without isolation of intermediates, without changing the solvent, and the yield and purity of the final product are still more than satisfactory. This modification of the present process is clearly less labor and time intensive than the synthetic route presented in EP 0 635 501 A1.

专利号:US-5952506-A
优先权日:1997-04-24
标题 :Process for the synthesis of 4- 6- (hexylcarbamoyloxy) hexylcarbamoyloxy!-piperidine-1-carboxylic acid 4-phenoxyphenyl ester
发明人：JIRKOVSKY IVO
权利人:AMERICAN HOME PROD
摘要:This invention is concerned with a new and improved process for the large scale production of 4- 6-(hexylcarbamoyloxy)hexylcarbainoyloxy!-piperidine-1-carboxylic acid 4-phenoxyphenyl ester, disclosed in European Patent Application 0 635 501 A1, published Jan. 25, 1995, a compound that inhibits cholesterol ester hydrolase (CEH) and acylcoenzyme A cholesterol acyltransferase (ACAT). In the invention process, 1-benzyl-4-hydroxypiperidine or 1-methyl-4-hydroxypiperidine is reacted with a carbonylating reagent such as carbonyldiimidazole (CDI) and 6-aminohexanol forming the intermediate 1-benzyl (or methyl)-4-(6-hydroxyhexylcarbamoyloxy)piperidine. Reaction of this intermediate with CDI and hexylamine gives the corresponding 1-benzyl (or methyl)-4- 6-(hexylcarbamoyloxy)-hexylcarbamoyloxy!piperidine. The N-benzyl or methyl group is concomitantly removed and replaced with the 4-phenoxyphenyloxycarbonyl group using 4-phenoxyphenyl chloroformate. n The process can be carried out from starting material to final product without isolation of intermediates, without changing the solvent, and the yield and purity of the final product are still more than satisfactory. This modification of the present process is clearly less labor and time intensive than the synthetic route presented in EP 0 635 501 A1.

专利号:US-6596840-B1
优先权日:1999-07-19
标题 :Method for producing modified polycarbonates
发明人：KRATSCHMER SILKE; HUCKS UWE; BUNZEL LOTHAR
权利人:BAYER AG
摘要:A process for the synthesis of polycarbonate is disclosed. The process entails reacting in the presence of at least one phosphonium salt as catalyst, at least one diphenol, at least one carbonic acid diester, and at least one alkyl group-substituted phenol chain terminator. The chain terminator is introduced in free form or as a transesterifiable compound under the conditions of the synthesis. The polycarbonate thus produced is suitable for preparing a variety of molded articles.

专利号:US-7674934-B2
优先权日:2004-08-05
标题:Stabilizers for use in NVP synthesis
发明人：HOEFER FRANK; BRAND ALEXANDRA; BOETTCHER ARND; BAUMANN KATRIN; VOGELSANG REGINA
权利人:BASF AG
摘要:A process for preparing N-alkenyl compounds by reacting the corresponding NH compounds with alkynes in the liquid phase in the presence of a catalyst, wherein the reaction is carried out in the presence of at least one stabilizer, and the use of stabilizers for increasing the selectivity in a process for preparing N-alkenyl compounds by reacting the corresponding NH compounds with alkynes in the liquid phase in the presence of a catalyst.

专利号:EP-0052836-A1
优先权日:1980-11-22
标题 :Phenoxybenzaldehydes and process for their preparation
发明人：HUETTELMAIER THOMAS DR; MILDENBERGER HILMAR DR; MATTERSTOCK KARL DR
权利人:HOECHST AG
摘要:Phenoxybenzaldehydes of the formula in which R1 is halogen, CN, NO2, (cyclo) alkyl, alkoxy, alkylthio, haloalkyl or methylenedioxy; R2 radicals of the formulas R3 H, halogen, CN, NO2, (halogen) alkyl, alkoxy, alkylthio; R2 + R3 also an (un) saturated hydrocarbon chain; X -O-, -S-, -SO-, -SO2-, -OCH2-, -CH2O-, -CH2-, -SCH2-, -CH2S-, -CO-, -CH = CH-, -N- or a chemical bond; Y O or S; R4 is halogen, CN, NO2, (halogen) alkyl, (halogen) alkoxy, cycloalkyl, alkoxy, alkylthio, phenyl or methylenedioxy, R5 is H, alkyl or cycloalkyl, n 0-5 and m 0-4 are starting materials for the Synthesis of effective insecticides and acaricides.

专利号:CN-102477452-A
优先权日:2010-11-22
标题:Enzymatic Synthesis of a Surfactant

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主要参考文献

参考标题:Non-Peptidic Inhibitors Of Human Neutrophil Elastase: The Design And Synthesis Of Sulfonanilide-Containing Inhibitors
作者:Katsuhiro Imaki,Takanori Okada,Yoshisuke Nakayama,Yuuki Nagao,Kaoru Kobayashi,Yasuhiro Sakai,Tetsuya Mohri,Takaaki Amino,Hisao Nakai,Masanori Kawamura |发布日期:1996.12
摘要:A Novel Series Of Pivaloyloxy Benzene Derivatives Has Been Identified As Potent And Selective Human Neutrophil Elastase (Hne) Inhibitors. Convergent Syntheses Were Developed In Order To Identify The Inhibitors Which Are Intravenously Effective In An Animal Model. A Compound Of Particular Interest Is The Sulfonanilide-Containing Analogues. Structure-Activity Relationships Are Discussed. Structural Requirements

合成参考文献

摘要:Okamoto, K.; Ohe, K., Science of Synthesis Knowledge Updates, (2020) 1, 142.
摘要:Lumb, J.-P.; Esguerra, K. V. N., Science of Synthesis: Catalytic Oxidation in Organic Synthesis, (2017) 1, 602.
摘要:S109 | PARCEDC | List of 7074 potential endocrine disrupting compounds (EDCs) by PARC T4.2 | DOI:10.5281/zenodo.10944198
摘要:Wang, X.; Hu, J., Science of Synthesis: Modern Strategies in Organofluorine Chemistry, (2025) 2.
参考文献:10.1080/08927010802008096
摘要:Ortlepp S, Pedpradap S, Dobretsov S, Proksch P. Antifouling activity of sponge-derived polybrominated diphenyl ethers and synthetic analogues. Biofouling. 2008;24(3):201–8. doi: 10.1080/08927010802008096.