2-(烯丙基氨基)苯甲酸乙酯 | 865873-29-6

• 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: 2-(烯丙基氨基)苯甲酸乙酯
• 英文名称: ethyl 2-(allylamino)benzoate
• 英文别名: Ethyl 2-(prop-2-enylamino)benzoate
• CAS: 865873-29-6
• 化学式: C₁₂H₁₅NO₂
• 分子量: 205.257
• InChiKey: PFLSQSMSCPXJMR-UHFFFAOYSA-N

物化性质

• 沸点：
  302.2±17.0 °C(Predicted)
• 密度：
  1.072±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  15
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  38.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-(烯丙基氨基)苯甲酸乙酯 在 [Ru(η³:η²:η³-dodeca-2,6,10-triene-1,12-diyl)Cl2] 水 作用下， 反应 0.33h， 以99%的产率得到2-氨基苯甲酸乙酯
  参考文献：
  名称：

  Ru(iv)-catalyzed isomerization of allylamines in water: A highly efficient procedure for the deprotection of N-allylic amines

  摘要：

  开发了一种普遍且高效的方法，用于在水相中去保护N-烯丙基底物，该方法使用催化量的双(烯丙基)钌(IV)复合物[Ru(η3:η2:η3-C12H18)Cl2] (1)和[{Ru(η3:η3-C10H16)(μ-Cl)Cl}2] (2)。

  DOI：

  10.1039/b506788j
• 作为产物：
  描述：

  3-溴丙烯 、 2-氨基苯甲酸乙酯 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以67%的产率得到2-(烯丙基氨基)苯甲酸乙酯
  参考文献：
  名称：

  Jain, Seema; Pandey, Neelesh; Kishore, Journal of the Indian Chemical Society, 2006, vol. 83, # 10, p. 1052 - 1054

  摘要：

  DOI：

文献信息

• Pyrido (2,3-d) pyrimidine derivatives, pharmaceutical compositions containing them and processes for preparing the pyrido (2,3-d) pyrimidine derivatives
  申请人：AMERICAN HOME PRODUCTS CORPORATION

  公开号：EP0018139A2

  公开（公告）日：1980-10-29

  The pyrido[2,3-d]pyrimidines are of the formula wherein R2 is hydrogen, hydroxy, alkyl, alkylthio, phenyl, 4-methoxyphenyl, 4-chlorophenyl, 1-pyrrolidinyl or methylphenylamino; R5 is hydroxy, alkylamino, 2-hydroxyethylamino, 2-alkoxymethylamino, dialkylamino, 4-methyl-1-piperazinyl, 4-morpholinyl or 1-pyrrolidinyl or amino with the provisos that if R8 is alkyl and R2 is phenyl then is other than amino and if R8 is alkyl and R2 is alkylthio then R5 is other than 1-pyrrolidinyl; is alkoxy, amino, mono- ordialkylamino, 2-hydroxyethylamino, 2-alkoxymethylamino or 2-(dialkylamino)-ethylamino; and R6 is hydrogen, alkyl, 2-alkoxyethyl, allyl, propargyl, phenyl, 4-methoxyphenyl, 4-chlorophenyl, benzyl, 4-methoxybenzyl, 4-chlorobenzyl, 4-(4-morpholinyl)-phenyl or piperonyl. The compounds are useful as anti-secretory agents. Some also exhibit anti-allergy activity. Processes for preparing the compounds are described and also novel intermediates useful in the processes.

  吡啶并[2,3-d]嘧啶的结构式为 其中 R2 是氢、羟基、烷基、烷硫基、苯基、4-甲氧基苯基、4-氯苯基、1-吡咯烷基或甲基苯基氨基；R5 是羟基、烷基氨基、2-羟乙基氨基、2-烷氧基甲基氨基、二烷基氨基、4-甲基-1-哌嗪基、4-吗啉基或 1-吡咯烷基或氨基，但如果 R8 是烷基，R2 是苯基，则不是氨基，如果 R8 是烷基，R2 是烷硫基，则 R5 不是 1-吡咯烷基； R6是氢、烷基、2-烷氧基乙基、烯丙基、丙炔基、苯基、4-甲氧基苯基、4-氯苯基、苄基、4-甲氧基苄基、4-氯苄基、4-(4-吗啉基)苯基或胡椒基。这些化合物可用作抗分泌剂。有些化合物还具有抗过敏活性。本文介绍了制备这些化合物的工艺以及在这些工艺中有用的新型中间体。
• Palladium-Catalyzed Mono-<i>N</i>-allylation of Unprotected Anthranilic Acids with Allylic Alcohols in Aqueous Media
  作者：Hidemasa Hikawa、Yuusaku Yokoyama

  DOI：10.1021/jo201691e

  日期：2011.10.21

  Palladium-catalyzed N-allylation of anthranilic acids 1a-j with allyl alcohol 2a in the presence of Pd(OAc)(2), sodium diphenylphosphinobenzene-3-sulfonate (TPPMS) in THF-H2O at room temperature gave only mono-N-allylated anthranilic acids 3a-j in good yields (70-98%). The reactions of 4-bromoanthranilic acid 1i with 2-methyl-3-buten-2-ol 2b showed complete chemoselectivity in N-allylation (neutral conditions) and C-vinylation (basic conditions). In our catalytic system, the keys to success are use of an unprotected anthranilic acid as a starting material and the presence of water in the reaction medium. The carboxyl group of anthranilic acid and water may play important roles for the smooth generation of the pi-allyl palladium species by activation of the hydroxyl group of the allylic alcohol.
• 4-hydroxy-2-quinolones. 22.* Synthesis and biological properties of 1-alkyl(aryl)-2-oxo-3-carbethoxy-4-hydroxyquinolines and their derivatives
  作者：L. V. Ukrainets、O. V. Gorokhova、S. G. Taran、P. A. Bezulyi、A. V. Turov、N. A. Marusenko、O. A. Evtifeeva

  DOI：10.1007/bf01169641

  日期：1994.7
• Jain, Seema; Pandey, Neelesh; Kishore, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2007, vol. 46, # 3, p. 529 - 531
  作者：Jain, Seema、Pandey, Neelesh、Kishore

  DOI：——

  日期：——
• Jain, Seema; Pandey, Neelesh; Kishore, Journal of the Indian Chemical Society, 2006, vol. 83, # 9, p. 938 - 940
  作者：Jain, Seema、Pandey, Neelesh、Kishore

  DOI：——

  日期：——