CAS: 94-14-4; Isobutyl 4-Aminobenzoate

化学文摘社编号94-14-4的有机化合物,其特征是其酯功能组,由p-氨基苯甲酸和异丁醇反应形成.该化合物一般是无色的,可粉色黄色,有温和的气味;在乙醇和乙醚等有机溶剂中溶解,但水溶解度有限.异丁基 p-氨基苯甲酸主要用于化妆品和制药业,由于能够吸收紫外线光,通常用作日光检查中的紫外线过滤器.此外,该化合物可用作各种配方的稳定剂或添加剂.该化合物具有低毒性,适合用于皮肤产品,但与许多化学物质一样,应当谨慎处理,遵循适当的安全准则,以尽量减少接触和潜在健康风险.

结构式图片

欧盟法规

ECHA物质ECHA物质C&L通报REACH预注册

上下游产品

isobutyl p-nitrobenzoate 2-methyl-propan-1-ol 4-amino-benzoic acid hydrogenchloride 4-phenacylamino-benzoic acid isobutyl ester 4-{[2-thioxo-5-(2,4,5-trichloro-phenoxymethyl)-[1,3,4]oxadiazol-3-ylmethyl]-amino}-benzoic acid isobutyl ester isobutyl 4-(4-hexyloxybenzylideneamino)benzoate isobutyl 4-(4-heptyloxybenzylideneamino)benzoate

合成工艺路线路线简述

  • 99-78-5 = 94-14-4
    反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium,Av 17X8 Solvents: 1-Butanol; 5 - 300 Min,1 Atm,40 °C
    标题:Hydrogenation Of Aromatic Nitro Compounds On Palladium-Containing Anion-Exchange Resins
    作者:Abdullaev,M. G.; Gebekova,Z. G.
    参考文献:Petroleum Chemistry 日期:2016 卷标:56(2) 页码:146-150]

    76480-03-0 = 94-14-4
    反应条件:1.1 Reagents: Hydrochloric Acid
    标题:Competing Snar Displacements Of Nitrite And Sn2 Displacements On The Alkyl Groups Of Alkyl P-Nitrobenzoates And O-Nitrobenzoates
    作者:Logue,Marshall W.; Han,Byung Hee
    参考文献:Journal Of Organic Chemistry 日期:1981 卷标:46(8) 页码:1638-42]

    = 94-14-4 [标题:Reaction Conditions
    标题:Liquid-Phase Hydrogenation Of P-Nitrobenzoic Acid Esters On Palladium Catalysts
    作者:Morogina,K.; Nasibulin,A. A.; Klyuev,M. V.
    参考文献:Neftekhimiya 日期:1998 卷标:38(4) 页码:277-281]

    99-78-5 = 94-14-4
    反应条件:1.1 Reagents: Cyclohexene Catalysts: Palladium Solvents: Ethanol; Reflux
    标题:Novel Curcumin Derivatives As P-Glycoprotein Inhibitors: Molecular Modeling,Synthesis And Sensitization Of Multidrug Resistant Cells To Doxorubicin
    作者:Sagnou,Marina; Novikov,Fedor N.; Ivanova,Ekaterina S.; Alexiou,Polyxeni; Stroylov,Victor S.; Et Al
    参考文献:European Journal Of Medicinal Chemistry 日期:2020 卷标:198]

    99-78-5 = 94-14-4
    反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Diacetate (Supported On Anionite Ab-17-8) Solvents: 1-Butanol; 60 Min,45 °C
    标题:Method Of Producing N-(N-Glucosylidene)Aminobenzoic Acid Esters
    参考文献:Russian Federation]

    150-13-0 = 94-14-4
    反应条件:1.1 Catalysts: Acetyl Chloride
    标题:Gas Chromatographic Analysis Of Amino Acids As The N-Heptafluorobutyryl Isobutyl Esters
    作者:Mackenzie,Samuel L.
    参考文献:Journal - Association Of Official Analytical Chemists 日期:1987 卷标:70(1) 页码:151-60]

    = 94-14-4 [标题:Reaction Conditions
    标题:Preparation Of Oxindoles As Protein Tyrosine Kinase And Protein Serine/threonine Kinase Inhibitors.
    参考文献:World Intellectual Property Organization]

    = 94-14-4 [标题:Reaction Conditions
    标题:Steric Effects In Acid-Catalyzed Decomposition And Base-Catalyzed Cyclization Of 1-(2-Alkoxycarbonylphenyl)-3-Phenyltriazenes
    作者:Pytela,Oldrich; Halama,Ales
    参考文献:Collection Of Czechoslovak Chemical Communications 日期:1996 卷标:61(5) 页码:751-763]

    = 94-14-4 [标题:Reaction Conditions
    标题:Preparation Of S-Triazine Derivatives As Light Stabilizers
    参考文献:United States]

    = 94-14-4 [标题:Reaction Conditions
    标题:S-Triazine Derivatives As Light Stabilizers
    参考文献:European Patent Organization]

    = 94-14-4 [标题:Reaction Conditions
    标题:Boron Trifluoride Ethyl Ether As An Effective Catalyst In The Synthesis Of Alkyl P-Aminobenzoates
    作者:Kadaba,Pankaja K.; Carr,Martin; Tribo,Mark; Triplett,John; Glasser,A. C.
    参考文献:Journal Of Pharmaceutical Sciences 日期:1969 卷标:58(11) 页码:1422-3
📜4-硝基苯甲酰氯置于4-二甲氨基吡啶,Palladium 10% On Activated Carbon,三乙胺,环己烯体系中,用 乙醇,二氯甲烷 作为反应溶剂,化学反应生成 异丁基4-氨基苯甲酸
参考文献:新型姜黄素衍生物作为p-糖蛋白抑制剂:多药耐药细胞对阿霉素的分子建模,合成和敏化.
标题:新型姜黄素衍生物作为p-糖蛋白抑制剂:多药耐药细胞对阿霉素的分子建模,合成和敏化.
摘要:数十年来,人们一直在研究mdr1 / P-糖蛋白(pgp)/ Abcb1多药转运体作为抗肿瘤治疗的药物靶点.已知天然产物姜黄素为能够阻断pgp介导的外排和使多药耐药(mdr)细胞对pgp转运的药物阿霉素(dox)敏感的化合物提供了有效的支架.我们进行了分子动力学模拟,并将姜黄素衍生物对接到pgp模型中.基于这些计算,提出了一系列具有预测的代谢稳定性和/或改善的结合亲和力的吡唑并姜黄素衍生物,用于合成和评估针对dox选择的k562 / 4亚型(k562人慢性粒细胞性白血病细胞系的衍生物)的mdr逆转能力.化合物16和19都是带有np-苯基羧酸酰胺取代基的二甲基姜黄素吡唑衍生物,是通过细胞内dox积累确定的最有效的pgp阻滞剂.此外,在无毒的亚微摩尔浓度16和19可使k562 / 4细胞对dox显着敏感.这些结果与16和19的非常好水溶性一起,表明姜黄素的新型吡唑并衍生物是开发临床适用的pgp拮抗剂的有前途的支架.
DOI:10.1016/j.Ejmech.2020.112331

海关参考信息

专利信息


专利号:US-7598291-B2
优先权日:2004-09-02
标题 :Methods and compositions for enhancing collagen and proteoglycan synthesis in the skin
发明人:NIMNI MARCEL; HAN BO
权利人:NIMNI MARCEL; HAN BO
摘要:A composition for application to the skin can stimulate the in vivo synthesis of collagen and proteoglycans and improve the appearance of the skin, increasing its elasticity and fullness. In general, a composition according to the present invention comprises: (1) an antioxidant compound in a quantity sufficient to enhance collagen synthesis in the skin; (2) an organic penetrant in which the antioxidant compound is soluble in a sufficient quantity that a concentration of the antioxidant compound sufficient to enhance collagen synthesis can be applied topically and penetrate the skin; (3) a mixture of essential amino acids; (4) a supplemental source of sulfur; and (5) a topical pharmaceutically acceptable carrier. The antioxidant compound can be lipoic acid, a lipoic acid analogue or derivative, a bioflavonoid, a constituent of ginkgo, or an isoflavone. The organic penetrant is preferably benzyl alcohol. Other ingredients, such as esters of tocopherol and ascorbic acid, can be included.

专利号:US-2010160244-A1
优先权日:2004-09-02
标 题 :Methods and compositions for enhancing collagen, proteoglycan, and glutathione synthesis in the skin
发明人:NIMNI MARCEL; HAN BO
权利人:NIMNI MARCEL; HAN BO
摘要:A composition for application to the skin can stimulate the in vivo synthesis of collagen and proteoglycans and improve the appearance of the skin, increasing its elasticity and fullness. In general, a composition according to the present invention comprises: (1) an antioxidant compound in a quantity sufficient to enhance collagen synthesis in the skin; (2) an organic penetrant in which the antioxidant compound is soluble in a sufficient quantity that a concentration of the antioxidant compound sufficient to enhance collagen synthesis can be applied topically and penetrate the skin; (3) a mixture of essential amino acids or hydrolyzed whey protein; (4) a supplemental source of sulfur; and (5) a topical pharmaceutically acceptable carrier. The antioxidant compound can be lipoic acid or a lipoic acid analogue or derivative. The organic penetrant is preferably benzyl alcohol. Other ingredients, such as esters of tocopherol and ascorbic acid, can be included.

专利号:US-2008214386-A1
优先权日:2004-03-01
标题:Catalyst for Cyclic Carbonate Synthesis
发明人:TAKAHASHI TOSHIKAZU; WATAHIKI TSUTOMU; YASUDA HIROYUKI; SAKAKURA TOSHIYASU
权利人:TAKAHASHI TOSHIKAZU; WATAHIKI TSUTOMU; YASUDA HIROYUKI; SAKAKURA TOSHIYASU
摘要:Provided are a solid catalyst which gives a cyclic carbonate at a high yield and a high selectivity, which is stable and which may be readily separated after reaction; and a method of industrially advantageous, inexpensive and safe production of a cyclic carbonate by the use of the catalyst. The catalyst contains an inorganic solid substance having a surface modified with an ionic substance containing a Group 15 element; or contains an ionic substance containing a Group 15 element, and an inorganic solid substance. The modifying group for surface modification of an inorganic solid substance is an ionic substance containing a Group 15 element. The ionic substance containing a Group 15 element is at least one substance selected from organic phosphonium salts, organic ammonium salts, organic arsonium salts and organic antimonium salts.

专利号:EP-1776333-B1
优先权日:2004-07-21
标 题:Ammonium salts and ammonium salt/mineral salt clathrate compounds for use as vehicle and effective form for pharmaco-medical applications and for use as phase transfer agents for chemical applications
发明人:REUTER UWE; OETTMEIER RALF; KASCH HELMUT
权利人:KASCH HELMUT
摘要:This invention relates to ammonium salts and stable storable ammonium salts and ammonium salt/mineral salt clathrate compounds (inclusion compounds, clusters) having acid dibasic anionic acid residues such as bicarbonate, to methods for producing them and to pharmaco-medical and chemical synthetic applications for said compounds. According to the invention, compounds for pharmaco-medical and chemical synthetic applications are produced which comprise the ammonium salt and ammonium salt/mineral salt clathrate compounds (inclusion compounds, clusters) having acid dibasic anionic acid residues of general formula I with R1, R2, R3 and R4=alkyl and substituted alkyl straight-chain or branched, optionally having an alcohol, ether, silyether, ester, amino or amide function, H or aryl-alkyl, with aryl being an aromatic or heteroaromatic ring having optionally additional substituents, such as alkyl having 1 to 4 C atoms, OH, NR*2 with R*2=O, alkyl with alkyl of between 1 and 4 C atoms or H, COOH, COOR, CN, NO2 and the cationic positive N+ is optionally part of an active agent, Y is a dibasic acid residue of an organic dicarboxylic acid or CO3-, corresponding to HY-=HCO3-, and x=0.5 to 30 represents the number of the mineral salt molecules for clathrate compound formation or 0. In pharmaco-medical applications applies the generalizable effectiveness principle according to which to ammonium salt/mineral salt cluster is used as vehicle and active agent for novel forms of application of nitrogen-containing active agent bases. In chemistry, these agents are used in the synthesis of active agents and valuable products, e.g. of cyclic carbonates.

专利号:US-7993390-B2
优先权日:2002-02-08
标 题:Implantable or insertable medical device resistant to microbial growth and biofilm formation
发明人:MILLER KATHLEEN M; BUCAY-COUTO WEENNA; LI JIANMIN
权利人:BOSTON SCIENT SCIMED INC
摘要:Disclosed are implantable or insertable medical devices that provide resistance to microbial growth on and in the environment of the device and resistance to microbial adhesion and biofilm formation on the device. In particular, the invention discloses implantable or insertable medical devices that comprise at least one biocompatible matrix polymer region, an antimicrobial agent for providing resistance to microbial growth and/or a microbial adhesion/biofilm synthesis inhibitor for inhibiting the attachment of microbes and the synthesis and accumulation of biofilm on the surface of the medical device. Also disclosed are methods of manufacturing such devices under conditions that substantially prevent preferential partitioning of any of said bioactive agents to a surface of the biocompatible matrix polymer and substantially prevent chemical modification of said bioactive agents.

专利号:US-2014315720-A1
优先权日:2012-10-24
标 题 :Polysaccharide ester microspheres and methods and articles relating thereto
发明人:FALLON DENIS G; GARRETT THOMAS S; KIZER LAWTON E; ZAZZARA KAREN L; COMBS MICHAEL T; JOHNSON RICHARD K; DEHART GARY
权利人:CELANESE ACETATE LLC
摘要:A method for producing a polysaccharide ester microsphere may include forming a polysaccharide ester product from a polysaccharide synthesis, wherein the polysaccharide ester product comprises a polysaccharide ester and a solvent; diluting the polysaccharide ester product, thereby yielding a polysaccharide ester dope; and forming a plurality of polysaccharide ester microspheres from the polysaccharide ester dope. Suitable polysaccharides may include, but are not limited to, starch, cellulose, hemicellulose, algenates, chitosan, and any combination thereof. Esters thereof may be organic esters (e.g., acetate and the like), inorganic esters (e.g., sulfonates and the like), or combinations thereof. Further, the solids conent of the polysaccharide ester dope, in some instances, may be greater than about 16 wt %.

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主要参考文献


1: Schmidt AC. Structural characteristics and crystal polymorphism of three local anaesthetic bases crystal polymorphism of local anaesthetic drugs: part VII. Int J Pharm. 2005 Jul 14;298(1):186-97.

合成参考文献


摘要:Journal of Medicinal Chemistry., 17(900), 1974
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