CAS: 92-64-8; N-Cyanoethyl-N-Hydroxyethylaniline

该化合物其结构特征为有机化合物,其结构包括一个以苯基氨基组和氢氧乙基酸基替换的丙烯基骨干,该化合物一般以固体或液体的形式出现,取决于其具体形式和纯度;已知其在药物和有机合成中的潜在用途,特别是由于有硝基功能组的存在,可参与各种化学反应,包括核生殖器添加物和循环添加物;氢氧乙基组有助于其极溶剂中的溶性,并可能影响其与生物系统的再活动与互动;此外,该苯基氨组可增强化合物形成氢联结的能力,影响其物理特性和生物活动;应参考安全数据,用于处理和接触准则,如任何化学物质,以确保适当的实验室做法.

英文名称N-Cyanoethyl-N-Hydroxyethylaniline
中文名称N-(2-氰乙基)-N-(2-羟乙基)苯胺
IUPAC名称3-((2-hydroxyethyl)(phenyl)amino)propanenitrile
其它别名3-(N-(2-Hydroxyethyl)anilino)propiononitrile
CAS编号92-64-8
MFCD编号:MFCD00035705
EINECS号:202-174-5
FDA UNII编号:UD2CS7WY8M
分子式:C11H14N2O
分子量:190.25
产品CID: 1965264
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: WZJJWQVBLSPALW-UHFFFAOYSA-N
InChI=1S/C11H14N2O/c12-7-4-8-13(9-10-14)11-5-2-1-3-6-11/h1-3,5-6,14H,4,8-10H2…
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

熔点68 °C
沸点315 °C at 760 mmHg
闪点183.9±23.7 °C
密度1.1±0.1 g/cm3
pKa:14.51±0.10(预测)
PSA:47.26
LogP:1.39898
折射率1.581
蒸汽压0.0±0.9 mmHg at 25°C
溶解性Not Miscible Or Difficult To Mix With Water.
外观形态无色至黄色至绿色透明液体
储存条件密封, 常温干燥保存
产品应用用作分散橙30,31,74,分散红43,56,72,97,137,177等染料的中间体.

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
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.
防范说明P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501
危险品标志Xi
安全声明26-36
危险类别码36/37/38
WGK Germany2

欧盟法规

ECHA物质C&L通报REACH预注册

上下游产品

CAS号107-13-1 丙烯腈 | CAS号122-98-5 N-羟乙基苯胺 | CAS号75-21-8 环氧乙烷 | CAS号1075-76-9 3-苯氨基丙腈

合成工艺路线路线简述

1075-76-9 + 75-21-8 = 92-64-8
反应条件:1.1 Reagents: Water Catalysts: Benzenesulfonic Acid,4-Methyl-,Zinc Salt (2:1)
标题:Manufacture Of N-Substituted-N-Hydroxyalkylanilines
参考文献:Japan]

= 92-64-8 [标题:Reaction Conditions
标题:Hydroxyalkylation Of Cyanoethylanilines
参考文献:United States]

= 92-64-8 [标题:Reaction Conditions
标题:N-(β-Hydroxyethyl)-N-(β-Cyanoethyl)Aniline
参考文献:Ussr]

= 92-64-8 [标题:Reaction Conditions
标题:N-β-Cyanoethyl-N-β-Acetoxyethylaniline
参考文献:Czechoslovakia]

= 92-64-8 [标题:Reaction Conditions
标题:N-Alkoxyethyl-Aniline Derivatives
参考文献:Japan]

= 92-64-8 [标题:Reaction Conditions
标题:N-β-Cyanoethyl-N-β-Hydroxyethylaniline Compounds
参考文献:Japan]

= 92-64-8 [标题:Reaction Conditions
标题:N-Substituted-N-(2-Cyanoethyl)Anilines
参考文献:United States]

= 92-64-8
反应条件:1.1 24 H,50 °C
标题:Method For Preparing N-Cyanoethyl-N-β-Hydroxyethylaniline By Utilizing Ionic Liquid
参考文献:China]

122-98-5 = 92-64-8
反应条件:1.1 Catalysts: 1-Butyl-3-Methylimidazolium Hydrogen Sulfate; 12 H,90 °C
标题:Synthesis Of N-Cyanoethyl-N-Hydroxyethylaniline Catalyzed By Acidic Ionic Liquid
作者:Guo,Hui; Yin,Yuanyuan; Zhang,Xueying; Zhuang,Yuwei; Cao,Jian; Et Al
参考文献:Yingyong Huaxue 日期:2020 卷标:37(5) 页码:512-517]

122-98-5 = 92-64-8
反应条件:1.1 Catalysts: Hydroquinone,Cuprous Acetate; 8 H,80 - 90 °C
标题:Selective Cyanoethylation Of N-(β-Hydroxyethyl)Aniline
作者:Sultankulov,A.; Yakubov,A. V.; Baltabaev,U. A.; Tulyaganov,S. R.
参考文献:O'Zbekiston Respublikasi Fanlar Akademiyasining Ma'Ruzalari 日期:2003 卷标:(1) 页码:80-84]

122-98-5 = 92-64-8
反应条件:1.1 Catalysts: Acetic Acid,Hydroquinone,Zinc Chloride Solvents: Water; 2 H,60 °C; 3 H,90 - 98 °C
标题:Preparation Of N-Cyanoethyl-N-Hydroxyethylaniline
参考文献:China]

1075-76-9 + 75-21-8 = 92-64-8
反应条件:1.1 Solvents: Acetic Acid; 2.5 H,< 0.3 Mpa,85 °C
标题:Preparation Of N-Cyanoethyl-N-Acetoxyethyl Aniline
参考文献:China]

1075-76-9 + 75-21-8 = 92-64-8
反应条件:1.1 80 - 85 °C
标题:Process For Preparation Of Hydroxyethyl Aniline Ester
参考文献:China]

1075-76-9 + 75-21-8 = 92-64-8
反应条件:1.1 Reagents: Water Catalysts: Zinc Chloride
标题:Preparation Of N-Alkyl-N-Hydroxyalkylanilines
参考文献:Japan]

1075-76-9 + 75-21-8 = 92-64-8 [标题:Reaction Conditions
标题:Preparation Of N-(2-Cyanoethyl)-N-(2-Hydroxyethyl)Aniline As A Dye Intermediate
参考文献:German Democratic Republic]

= 92-64-8 [标题:Reaction Conditions
标题:N-(β-Hydroxyethyl)-N-(β-Cyanoethyl)Aniline
参考文献:German Democratic Republic

环氧乙烷,3-(苯氨基)丙腈置于溶剂黄146体系中,95.0~120.0 °C,300.01 Kpa 条件下,反应 3.0H,反应生成 N-(2-氰乙基)-N-(2-羟乙基)苯胺
参考文献:N-氰乙基-N-乙酰氧乙基苯胺的制备方法
标题:N-氰乙基-N-乙酰氧乙基苯胺的制备方法
摘要:本发明提供一种n‑氰乙基‑n‑乙酰氧乙基苯胺的制备方法.所述制备方法包括以下步骤:步骤1),使n‑氰乙基苯胺与环氧乙烷进行羟化反应,得到羟化物n‑氰乙基‑n‑羟乙基苯胺;步骤2),使所述羟化物n‑氰乙基‑n‑羟乙基苯胺与醋酐和/或醋酸进行酯化反应,得到酯化物.通过本发明的制备方法制备的n‑氰乙基‑n‑乙酰氧乙基苯胺成本低,步骤简单,且所得产物收率高,纯度高,蒸馏出来的醋酸可作为其他反应用,节约资源.

海关参考信息

2922110001-单乙醇胺
2926909090-其他腈基化合物
💡 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-4035350-A
优先权日:1975-01-30
标题:Process for the preparation of water-soluble azo dyestuffs by reacting an aromatic amine and a coupling component with alkali metal nitrite or alkyl nitrite in the absence of acid
发明人：LANDLER JOSEF; WORFEL ERHARD
权利人:HOECHST AG
摘要:A new and very advantageous Process had been found for the preparation of azo dyestuffs by diazotation and coupling in which the synthesis is carried out without the hitherto usual addition of an acid, with the proviso that at least one of the diazo and coupling components contains at least one acid group. Besides the saving of reaction material and subsequently of alkali for neutralization of the reaction medium and isolation of the dyestuff, highly concentrated solutions of the dyestuff and salt-free or practically salt-free dyestuffs can be obtained, and waste-water is no longer charged with big amounts of salts.

专利号:CN-105481623-B
优先权日:2015-12-01
标题:A kind of synthesis technique of hydroxyethylaniline carboxylate (III)

专利号:CN-108069875-B
优先权日:2016-11-16
标题:Synthesis process of N-cyanoethyl-N-benzoyloxyethylaniline

专利号:CN-115677534-A
优先权日:2022-09-22
标题 :A kind of raw material of N-cyanoethyl-N-hydroxyethylaniline fully utilizes the production synthesis process