CAS: 31197-69-0; Ethyl 2-Cyclohexyl-2-(2-Hydroxyphenyl)Acetate

该化合物是一种合成酯化合物,其特点是环氧基和氢氧苯基功能组,这种结构具有独特的化学特性,在有机合成和制药中间体中具有价值.氢氧基组增强反应性,促进进一步的衍生,而环氧基会有助于消毒稳定性.其酯功能确保其与一系列溶剂和反应条件的兼容性.该化合物由于其立体中心,在培养手动分子方面特别有用.该化合物可用于研究和工业应用的高纯度,确保合成途径的一贯性.建议适当的处理和储存以维持稳定性.

英文名称Ethyl 2-Cyclohexyl-2-(2-Hydroxyphenyl)Acetate
中文名称乙基2-环己基-2-羟基苯乙酸酯
IUPAC名称ethyl 2-cyclohexyl-2-(2-hydroxyphenyl)acetate
其它别名Ethyl 2-Cyclohexyl-2-Hydroxy-Phenylacetate; Oxybutynin Impurity 2; Ethyl 2-Cyclohexyl-2-Hydroxy-2-Phenylacetate; Ethyl α-Cyclohexylmandelate; α-Cyclohexyl-α-Hydroxy-Benzeneacetic Acid Ethyl Ester; Oxybutynin Impurity 2 (Phenylcyclohexylglycolic Acid Ethyl Ester); Benzeneacetic Acid, α-Cyclohexyl-α-Hydroxy-, Ethyl Ester; Oxybutynin Impurity 11
CAS编号31197-69-0
MFCD编号:MFCD04973599
分子式:C16H22O3分子量:262.35
产品CID: 1299550
产品分类分析化学 → 标准品 → 药典标准品和杂质标准品

相似结构搜索
InChIKey: OKSWMMZQZJBIKC-UHFFFAOYSA-N
InChI=1S/C16H22O3/c1-2-19-16(18)15(12-8-4-3-5-9-12)13-10-6-7-11-14(13)17/h6-7,10-12,15,17H,2-5,8-9H2,1H3
计算化学: 氢键受体数3.0氢键供体数1.0可旋转键数5.0

物理性质

PSA:46.53
LogP:3.0176
溶解性Chloroform (Slightly), Ethyl Acetate (Slightly)
外观形态透明无色至淡黄色油状物
储存条件冰箱

MSDS等安全信息

上下游产品

phenylglyoxylic acid ethyl ester cyclohexylmagnesium bromide Cyclohexyl iodide hydroxy-phenyl-acetic acid ethyl estercyclohexylmandelic acid Cyclohexyl-phenyl-glykolsaeure-2-dimethylamino-propylester Cyclohexyl-hydroxy-phenyl-acetic acid 1-aza-bicyclo[2.2.2]°Ct-3-yl ester Cyclohexyl phenyl ketone

合成工艺路线路线简述

合成目标产物 Ethyl 2-Cyclohexyl-2-Hydroxy-Phenylacetate 主要起始原料 Iodocyclohexane And Ethyl Mandelate
(文献来源)合成步骤主要原料 Iodocyclohexane 和 Ethyl Mandelate

📜苯甲酰甲酸乙酯,环己基溴化镁以to Give Ethyl 2-Cyclohexyl-2-Hydroxy-2-Phenylacetate,Which的收率获得产物乙基2-环己基-2-羟基苯乙酸酯
参考文献:Production Method Of 2-Cyclohexyl-2-Hydroxy-2-Phenylacetic Acid Intermediate Therefor And Production Method Thereof
标题:Production Method Of 2-Cyclohexyl-2-Hydroxy-2-Phenylacetic Acid Intermediate Therefor And Production Method Thereof
摘要:本发明涉及通过工业手段,经济,安全地高产生产用作制药中间体的2-环己基-2-羟基-2-苯乙酸.通过在路易斯酸存在下,反应环己烯和苯甲酰甲酯,得到新型2-(2'-环己烯-1'-基)-2-羟基-2-苯乙酸酯,再经水解还原可得到2-环己基-2-羟基-2-苯乙酸.

海关参考信息

2902600000-乙苯
2902700000-异丙基苯
2905122000-异丙醇
2905310000-1,2-乙二醇
💡 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:US-2010184989-A1
优先权日:2007-03-12
标题 :De Novo Synthesis of Conjugates
发明人：RIGGS-SAUTHIER JENNIFER; DENG BO-LIANG; REN ZHONGXU; ZHANG WEN; GU XUYUAN; DUARTE FRANCO J
权利人:NEKTAR THERAPEUTICS
摘要:The invention provides methods for the preparation of small molecule drugs that are chemically modified by covalent attachment of a water-soluble oligomer obtained from a water-soluble oligomer composition. Such drugs are produced through modification of a synthetic pathway to attach the oligomer to an intermediate compound followed by completion of the synthetic path.

专利号:WO-2008112286-A9
优先权日:2007-03-12
标题 :De novo synthesis of conjugates

专利号:WO-2008112286-A2
优先权日:2007-03-12
标题:De novo synthesis of conjugates