(Z)-3-(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)acrylic acid | 80231-69-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: (Z)-3-(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)acrylic acid
• 英文别名: (Z)-3-(7-methyl-2-oxo-1H-quinolin-3-yl)prop-2-enoic acid
• CAS: 80231-69-2
• 化学式: C₁₃H₁₁NO₃
• 分子量: 229.235
• InChiKey: PXACMPAZXVTQLQ-PLNGDYQASA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.93
• 重原子数：
  17.0
• 可旋转键数：
  2.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  70.16
• 氢给体数：
  2.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  (Z)-3-(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)acrylic acid 在 硫酸 、 三氯氧磷 作用下， 生成
  参考文献：
  名称：

  Synthesis of Selenolo(2,3-b)quinoline-2-carboxylic Ethyl Esters: Cytogenetic Studies on Human Peripheral Blood Leucocyte Cultures, and Anti-Bacterial Studies, and Anti-Fungal Studies of Their Effects

  摘要：

  The compounds selenolo(2,3-b)quinoline-2-carboxylic ethyl esters were synthesized in good yields by the reaction of 3-(2-chloro-3-quinolyl)actylic ethyl esters, with the nucleophilic reagent sodium diselenide in ethanol medium under a nitrogen atmosphere. Cytogenetic studies on human blood leucocytes in vitro were evaluated for some of the synthesized compounds. Most of the synthesized compounds were tested for their antibacterial and antifungal activities.

  DOI：

  10.1080/104265090889512
• 作为产物：
  描述：

  2-氯-7-甲基-3-喹啉甲醛 在 哌啶 、 盐酸 、 PPA 作用下， 以 吡啶 、 乙醇 为溶剂， 反应 3.5h， 生成 (Z)-3-(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)acrylic acid
  参考文献：
  名称：

  一种多用途的喹啉和相关稠合吡啶的新合成方法。第9部分。2-氯喹啉-3-甲醛的合成应用

  摘要：

  标题化合物的2-氯基已被H，I，OH，SR，Li，CO 2 H，CHO，Ph，哌啶和N 3取代（得到四唑）。醛基也已转化为肟，和丙烯酸衍生物。由这些及相关衍生物制得了各种稠合喹啉，包括噻吩基，哒嗪基，对苯二酚，吡喃基，噻喃基和呋喃喹啉。

  DOI：

  10.1039/p19810002509

文献信息

• A versatile new synthesis of quinolines and related fused pyridines. Part 9. Synthetic application of the 2-chloroquinoline-3-carbaldehydes
  作者：Otto Meth-Cohn、Bramha Narine、Brian Tarnowski、Roy Hayes、Amitis Keyzad、Salah Rhouati、Andrew Robinson

  DOI：10.1039/p19810002509

  日期：——

  SR, Li, CO2H, CHO, Ph, piperidine, and N3(giving a tetrazole). The aldehyde group has also been converted into oxime, hydrazone, and acrylic acid derivatives. From these and related derivatives a variety of fused quinolines have been made including thieno-, pyridazino-, tropono-, pyrano-, thiopyrano-, and furo-quinolines.

  标题化合物的2-氯基已被H，I，OH，SR，Li，CO 2 H，CHO，Ph，哌啶和N 3取代（得到四唑）。醛基也已转化为肟，和丙烯酸衍生物。由这些及相关衍生物制得了各种稠合喹啉，包括噻吩基，哒嗪基，对苯二酚，吡喃基，噻喃基和呋喃喹啉。
• AN EFFICIENT SYNTHESIS OF DIHYDRO SELENOLO (2,3-<i>b</i>)QUINOLINE-2-CARBOXYLIC ETHYL ESTERS AND 2-SELENOXO-1, 2-DIHYDRO-3-CARBETHOXY ETHYL QUINOLINES—THEIR ANTI-BACTERIAL STUDIES
  作者：V. Nithyadevi、P. Selvi、S. P. Rajendran

  DOI：10.1080/10426500490485101

  日期：2004.11.1

  The compounds dihydro selenolo(2,3-b)quinoline-2-carboxylic ethyl esters and 2-selenoxo-1, 2-dihydro-3-carbethoxy ethyl quinolines were synthesized in varying yields upon reacting 3-(2-chloro-3-quinolyl)acrylic methyl esters with the nucleophilic reagent sodium hydrogen selenide in ethanol medium under nitrogen atmosphere.
• METH-COHN, O.;NARINE, B.;TARNOWSKI, B.;HAYES, R.;KEYZAD, A.;RHOUATI, S.;R+, J. CHEM. SOC. PERKIN TRANS., 1981, N 9, 2509-2517
  作者：METH-COHN, O.、NARINE, B.、TARNOWSKI, B.、HAYES, R.、KEYZAD, A.、RHOUATI, S.、R+

  DOI：——

  日期：——
• Synthesis of Selenolo(2,3-b)quinoline-2-carboxylic Ethyl Esters: Cytogenetic Studies on Human Peripheral Blood Leucocyte Cultures, and Anti-Bacterial Studies, and Anti-Fungal Studies of Their Effects
  作者：V. Nithyadevi、S. P. Rajendran

  DOI：10.1080/104265090889512

  日期：2005.8.1

  The compounds selenolo(2,3-b)quinoline-2-carboxylic ethyl esters were synthesized in good yields by the reaction of 3-(2-chloro-3-quinolyl)actylic ethyl esters, with the nucleophilic reagent sodium diselenide in ethanol medium under a nitrogen atmosphere. Cytogenetic studies on human blood leucocytes in vitro were evaluated for some of the synthesized compounds. Most of the synthesized compounds were tested for their antibacterial and antifungal activities.