N，N-二乙基-N-{4-[2-硝基乙烯基]苯基}胺 | 64462-51-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: N，N-二乙基-N-{4-[2-硝基乙烯基]苯基}胺
• 英文名称: β-nitro-4-(diethylamino)styrene
• 英文别名: N,N-diethyl-4-(trans-2-nitro-vinyl)-aniline；N,N-Diaethyl-4-(trans-2-nitro-vinyl)-anilin；4-(N,N-diethyl)amino-β-nitrostyrene；N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline
• CAS: 64462-51-7；97562-40-8；147764-76-9
• 化学式: C₁₂H₁₆N₂O₂
• mdl: MFCD00544872
• 分子量: 220.271
• InChiKey: AATYCRRVMKWSAC-MDZDMXLPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  16
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.333
• 拓扑面积：
  49.1
• 氢给体数：
  0
• 氢受体数：
  3

安全信息

• 危险等级：
  IRRITANT

反应信息

• 作为反应物：
  描述：

  N，N-二乙基-N-{4-[2-硝基乙烯基]苯基}胺 在 lithium aluminium tetrahydride 、 乙醚 作用下， 生成 4-(2-aminoethyl)-N,N-diethylaniline
  参考文献：
  名称：

  Mescaline Analogs. V. p-Dialkylamino-β-phenethylamines and 9-(β-Aminoethyl)julolidine

  摘要：

  DOI：

  10.1021/jo01118a038
• 作为产物：
  描述：

  N,N-二乙基-4-氨基苯甲醛 在 乙酸铵 作用下， 以 硝基甲烷 为溶剂， 生成 N，N-二乙基-N-{4-[2-硝基乙烯基]苯基}胺
  参考文献：
  名称：

  Organic nonlinear optical material and nonlinear optical device

  摘要：

  公开号：

  EP0326133B1

文献信息

• Generation of nitroalkanes, hydroximoyl halides and nitrile oxides from the reactions of β-nitrostyrenes with Grignard or organolithium reagents
  作者：Ching-Fa Yao、Kuo-Hsi Kao、Ju-Tsung Liu、Cheng-Ming Chu、Yeh Wang、Wen-Chang Chen、Yu-Mei Lin、Wen-Wei Lin、Ming-Chung Yan、Jing-Yuan Liu、Ming-Ching Chuang、Jin-Lien Shiue

  DOI：10.1016/s0040-4020(97)10356-8

  日期：1998.1

  products 6 and/or 7 are observed if the nitronates, generated from the substrate 1a, are added to 85% aqueous H2SO4 but only the hydrolyzed carboxylic acids 9 are generated when the β-nitrostyrenes 2 are reacted with Grignard reagents and worked up under the same condition. The nitrile oxides 7 can undergo 1,3-dipolar cycloaddition with alkenes or alkynes to generate 2-isoxazolines or isoxazoles. A one-pot

  β型硝基苯乙烯1或2与格氏或有机锂试剂反应在乙醚或THF溶液由1,4-加成中间nitronates以产生甲。当用稀盐酸处理A时，获得高产率的硝基烷3（和肟4）或5。当将中间体A缓慢加入到冰冷的浓氢卤酸中时，可以分离出羟甲酰卤6、8或一氧化氮7。如果从基材1a产生的硝酸盐观察到相同的产物6和/或7。将β-硝基苯乙烯2加入到85％的H 2 SO 4水溶液中，但是当β-硝基苯乙烯2与格氏试剂反应并在相同条件下进行后处理时，仅产生水解的羧酸9。腈氧化物7可与烯烃或炔烃进行1，3-偶极环加成反应以生成2-异恶唑啉或异恶唑。据报道，通过分子内一氧化氮-烯烃环加成反应可以一锅合成[n，3,0]双环（n = 3或4）化合物23-27。
• Alcohol Mediated Synthesis of 4-Oxo-2-aryl-4<i>H</i>-chromene-3-carboxylate Derivatives from 4-Hydroxycoumarins
  作者：Manoj R. Zanwar、Mustafa J. Raihan、Sachin D. Gawande、Veerababurao Kavala、Donala Janreddy、Chun-Wei Kuo、Ram Ambre、Ching-Fa Yao

  DOI：10.1021/jo301044y

  日期：2012.8.3

  The unusual alcohol mediated formation of 4-oxo-2-aryl-4H-chromene-3-carboxylate (flavone-3-carboxylate) derivatives from 4-hydroxycoumarins and β-nitroalkenes in an alcoholic medium is described. The transformation occurs via the in situ formation of a Michael adduct, followed by the alkoxide ion mediated rearrangement of the intermediate. The effect of the different alcohol and nonalcohol media on

  这种不寻常的醇介导的4-氧代-2-芳基-4-的形成ħ色烯-3-羧酸甲酯（黄酮-3-羧酸）衍生物由4-羟基香豆素和β-硝基烯烃在醇介质进行说明。该转化通过原位形成迈克尔加合物而发生，随后是醇盐离子介导的中间体重排。研究了不同醇和非醇介质对反应的影响。
• TREATMENT OF DRUG-RESISTANT CANCER WITH 2-ARYL-2-(3-INDOLYL) ACETOHYDROXAMATES
  申请人：New Mexico Technical Research Foundation

  公开号：US20150105439A1

  公开（公告）日：2015-04-16

  A pharmaceutical composition, a method of producing same, and a method of providing cancer therapy therein comprising a pharmaceutically acceptable excipient or carrier and a compound Formula 3 as follows: or a pharmaceutically acceptable salt or prodrug thereof, wherein: R 1 , R 2 , R 3 and R 4 are optionally substituted and are hydrogen, haloalkyl, aryl, fused aryl, carbocyclic, a heterocyclic group, a heteroaryl group, C 1-10 alkyl, alkenyl, alkynyl, arylalkyl, arylalkenyl, arylalkynyl, heteroarylalkyl, heteroarylalkenyl, carbocycloalkyl, heterocycloalkyl, hydroxyalkyl, aminoalkyl, carboxyalkyl, nitroalkyl, cyanoalkyl, acetamidoalkyl, acyloxyalkyl, hydroxyl, alkoxy, acetoxy, amino, alkylamino, acetamido.

  一种药物组合物，其制备方法以及其中提供癌症治疗的方法，包括一个药用可接受的赋形剂或载体和一个化合物Formula 3，如下所示：或其药用可接受的盐或前药，其中：R1、R2、R3和R4可选择地被取代，可以是氢、卤代烷基、芳基、融合芳基、碳环、杂环基、杂芳基、C1-10烷基、烯基、炔基、芳基烷基、芳基烯基、芳基炔基、杂芳基烷基、杂芳基烯基、碳环烷基、杂环烷基、羟基烷基、氨基烷基、羧基烷基、硝基烷基、氰基烷基、乙酰氨基烷基、酰氧基烷基、羟基、烷氧基、乙酰氧基、氨基、烷基氨基、乙酰氨基。
• Efficient conversion of nitronate into nitrile oxide using cyanuric chloride. One-pot synthesis of bicyclic isoxazolines and isoxazoles from nitroalkenes
  作者：Shijay Gao、Zhijay Tu、Chun-Wei Kuo、Ju-Tsung Liu、Cheng-Ming Chu、Ching-Fa Yao

  DOI：10.1039/b606717d

  日期：——

  Bicyclic isoxazolines and isoxazoles are obtained in good yields by proceeding through a convenient one-pot, two-step procedure utilizing 2,4,6-trichloro-1,3,5-triazine (TCT) as a dehydrating agent.

  通过使用2,4,6-三氯-1,3,5-三嗪（TCT）作为脱水剂，通过方便的一锅两步程序，可以高收率获得双环异恶唑啉和异恶唑。
• PREPOLYMER, CURABLE MATERIAL, COATING COMPOSITION, NON-LINEAR OPTICAL MATERIAL, OPTICAL WAVEGUIDE AND LIGHT CONTROL DEVICE
  申请人：Asahi Glass Company, Limited

  公开号：EP2889684A1

  公开（公告）日：2015-07-01

  Provided are: a prepolymer which is capable of forming a non-linear optical material that has excellent non-linear optical effect, heat resistance, withstand voltage and transparency; a curable material which contains the prepolymer; a coating composition which contains the curable material and a solvent; a non-linear optical material which is obtained by curing the curable material; an optical waveguide which uses the non-linear optical material; and a light control device which is provided with the optical waveguide. The present invention uses a prepolymer having a crosslinkable functional group, which is obtained by reacting one or more compounds (X) that are selected from the group consisting of compounds (X1), compounds (X2) and compounds (X3), a compound (Y) that is represented by formula (Y), a compound (Z) that has three or more phenolic hydroxyl groups, and an organic compound (B) that exerts a non-linear optical effect and has a reactive group.

  本发明提供了：一种能够形成非线性光学材料的预聚物，该材料具有优异的非线性光学效果、耐热性、耐电压性和透明度；一种包含该预聚物的可固化材料；一种包含该可固化材料和溶剂的涂层组合物；一种通过固化该可固化材料而获得的非线性光学材料；一种使用该非线性光学材料的光波导；以及一种配备该光波导的光控制装置。本发明使用了一种具有可交联官能团的预聚物，该预聚物是通过将一种或多种选自化合物（X1）、化合物（X2）和化合物（X3）组成的组的化合物（X）、由式（Y）表示的化合物（Y）、具有三个或多个酚羟基的化合物（Z）和具有非线性光学效应并具有活性基团的有机化合物（B）反应而得到的。