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3-(2-Nitrophenyl)-1-[4-(trifluoromethyl)phenyl]prop-2-en-1-one | 1333117-05-7

中文名称
——
中文别名
——
英文名称
3-(2-Nitrophenyl)-1-[4-(trifluoromethyl)phenyl]prop-2-en-1-one
英文别名
——
3-(2-Nitrophenyl)-1-[4-(trifluoromethyl)phenyl]prop-2-en-1-one化学式
CAS
1333117-05-7
化学式
C16H10F3NO3
mdl
——
分子量
321.256
InChiKey
XJXGLGMZGVEUMD-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    4.2
  • 重原子数:
    23
  • 可旋转键数:
    3
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.06
  • 拓扑面积:
    62.9
  • 氢给体数:
    0
  • 氢受体数:
    6

上下游信息

  • 下游产品
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    3-(2-Nitrophenyl)-1-[4-(trifluoromethyl)phenyl]prop-2-en-1-one盐酸二氢吡啶 、 (R)-3,3'-bis(9-phenylanthracen-10-yl)-1,1'-binapthyl-2,2'-diyl-phosphoric acid 、 铁粉 作用下, 以 乙醇乙酸乙酯 为溶剂, 反应 40.0h, 生成 (S)-2-(4-(trifluoromethyl)phenyl)-1,2,3,4-tetrahydroquinoline
    参考文献:
    名称:
    继电器中的可见光感应/布朗斯台德酸催化对映选择性合成四氢喹啉
    摘要:
    已经开发了一种将布朗斯台德酸催化与可见光诱导相结合的有效方法,用于高对映选择性合成四氢喹啉。这种温和的过程通过继电可见光诱导的环化/手性磷酸催化的转移氢化反应,将2-氨基烯酮直接转化为具有优异对映选择性的2-取代的四氢喹啉。
    DOI:
    10.1021/acs.orglett.9b01354
  • 作为产物:
    参考文献:
    名称:
    继电器中的可见光感应/布朗斯台德酸催化对映选择性合成四氢喹啉
    摘要:
    已经开发了一种将布朗斯台德酸催化与可见光诱导相结合的有效方法,用于高对映选择性合成四氢喹啉。这种温和的过程通过继电可见光诱导的环化/手性磷酸催化的转移氢化反应,将2-氨基烯酮直接转化为具有优异对映选择性的2-取代的四氢喹啉。
    DOI:
    10.1021/acs.orglett.9b01354
点击查看最新优质反应信息

文献信息

  • Selective Reduction of Nitroarenes by a Hantzsch 1,4-Dihydropyridine: A Facile and Efficient Approach to Substituted Quinolines
    作者:Qiang Liu、Rui-Guang Xing、Ya-Nan Li、Yi-Feng Han、Xia Wei、Jing Li、Bo Zhou
    DOI:10.1055/s-0030-1260609
    日期:2011.7
    An efficient reductive cyclization of o-nitrocinnamoyl compounds was achieved by employing a Hantzsch 1,4-dihydropyridine ester as a biomimetic reducing agent in the presence of catalytic palladium on carbon. This approach was successfully applied to the synthesis of substituted quinolines. quinolines - reductive cyclization - Hantzsch ester - biomimetic reducing agent
    在催化/碳存在下,通过使用Hantzsch 1,4-二氢吡啶酯作为仿生还原剂,可实现邻硝基肉桂酰基化合物的有效还原环化。该方法已成功应用于取代喹啉的合成。 喹啉-还原环化-汉茨酯-仿生还原剂
  • Ag(I)-promoted Decarboxylative Annulation of α-Oxocarboxylic Acids with (E)-3-(2-aminophenyl)-1-Phenylprop-2-en-1-ones Toward 3,4- Functionalized Quinolines
    作者:Xiaodong Fan、Chang Wang、Jiang Cheng
    DOI:10.2174/1570178617999201106141315
    日期:2021.10
    <p>An efficient Ag-promoted decarboxylative cyclization of α-oxocarboxylic acids with (E)-3- (2-aminophenyl)-1-phenylprop-2-en-1-ones has been developed to afford a series of functionalized quinolines in moderate to good yields. This method was compatible with a variety of functional groups and provided an attractive method toward phenyl(2-phenylquinolin-3-yl)methanones.</p> </sec></div> <div class="value-text ch">一种高效的Ag促进的α-<a href=https://www.molaid.com/MS_232084 target="_blank">羧酸</a>与(E)-3-(2-<a href=https://www.molaid.com/MS_37224 target="_blank">氨</a>基苯基)-1-苯基丙-2-烯-1-酮的脱羧环化反应已经开发出来,产率中等至良好,得到一系列官能化<a href=https://www.molaid.com/MS_51724 target="_blank">喹啉</a>。这种方法兼容多种官能团,并提供了一种吸引人的合成苯基(<a href=https://www.molaid.com/MS_277053 target="_blank">2-苯基喹啉</a>-3-基)甲酮的方法。</div> </div> </li> <li class="feature-list-item"> <div class="content-title">Pd-Catalyzed Cross-Coupling of Aryl Carboxylic Acids with Propiophenones through a Combination of Decarboxylation and Dehydrogenation</div> <div class="value"> <div class="value-text"> <span>作者:</span>Jun Zhou、Ge Wu、Min Zhang、Xiaoming Jie、Weiping Su </div> <div class="value-text"> <span>DOI:</span>10.1002/chem.201200829 </div> <div class="value-text"> <span>日期:</span>2012.6.25 </div> <div class="value-text en">A Heck of a reaction: With a PCy3‐supported Pd catalyst, <span style='color:#ff0000'>aryl</span> <span style='color:#ff0000'>carboxylic</span> <span style='color:#ff0000'>acids</span> cross‐couple to saturated <span style='color:#ff0000'>propiophenones</span> <span style='color:#ff0000'>through</span> a <span style='color:#ff0000'>combination</span> of <span style='color:#ff0000'>decarboxylation</span> and <span style='color:#ff0000'>dehydrogenation</span> to give chalcones bearing a variety of functional groups in generally good yields (see scheme). Furthermore, a one‐pot procedure, involving this reaction and a subsequent selective hydrogenative cyclization process, has</div> <div class="value-text ch">反应的难点:在PCy 3负载的Pd催化剂上,芳基<a href=https://www.molaid.com/MS_232084 target="_blank">羧酸</a>通过脱羧和脱氢的组合与饱和的<a href=https://www.molaid.com/MS_13598 target="_blank">苯乙酮</a>交联,以通常的高收率得到带有各种官能团的<a href=https://www.molaid.com/MS_13396 target="_blank">查耳酮</a>(见方案)。此外,已经开发出一种涉及该反应和随后的选择性氢化环化过程的一锅法,用于从2-硝基<a href=https://www.molaid.com/MS_11570 target="_blank">苯甲酸</a>轻松合成<a href=https://www.molaid.com/MS_51724 target="_blank">喹啉</a>衍<a href=https://www.molaid.com/fenzi/4147 target="_blank">生物</a>。</div> </div> </li> <li class="feature-list-item"> <div class="content-title">Enantioselective Synthesis of 1,3-Benzothiazine Derivatives: An Organocatalytic Chemoselective Approach</div> <div class="value"> <div class="value-text"> <span>作者:</span>Prasenjit Gayen、Prasanta Ghorai </div> <div class="value-text"> <span>DOI:</span>10.1021/acs.orglett.3c01120 </div> <div class="value-text"> <span>日期:</span>2023.6.2 </div> <div class="value-text en">Herein, a highly chemoselective 1,2-addition of thiols with 2-isothiocyanatochalcones followed by an enantioselective intramolecular thia-Michael addition cascade has been established to construct enantioenriched [1,3]-benzothiazine derivatives for the first time. The cinchona-derived squaramide catalyst provides good to excellent yield and enantioselectivity of the products with broad substrate adaptability</div> <div class="value-text ch">在此,首次建立了<a href=https://www.molaid.com/MS_22128 target="_blank">硫</a>醇与 2-异<a href=https://www.molaid.com/MS_22128 target="_blank">硫</a><a href=https://www.molaid.com/MS_34841 target="_blank">氰</a>基<a href=https://www.molaid.com/MS_13396 target="_blank">查耳酮</a>的高度<a href=https://www.molaid.com/fenzi/4464 target="_blank">化学</a>选择性 1,2-加成,然后是对映选择性分子内<a href=https://www.molaid.com/MS_22128 target="_blank">硫</a>-迈克尔加成级联,以构建对映体富集的 [1,3]-苯并<a href=https://www.molaid.com/MS_274754 target="_blank">噻嗪</a>衍<a href=https://www.molaid.com/fenzi/4147 target="_blank">生物</a>。<a href=https://www.molaid.com/MS_5552 target="_blank">金</a>鸡纳衍生的 squaramide 催化剂提供了良好的产品收率和对映选择性,具有广泛的底物适应性。此外,该策略已扩展到二苯基氧化膦亲核试剂,以获得富含对映体的有机<a href=https://www.molaid.com/MS_20108 target="_blank">磷</a>取代的 [1,3]-苯并<a href=https://www.molaid.com/MS_274754 target="_blank">噻嗪</a>。放大反应和合成转化证明了该协议的可行性。</div> </div> </li> </ul> <a href="https://chem.molaid.com/material/detail?source=UserSourcePortal&id=3101921yfe7fad1c55M0&inchikey=XJXGLGMZGVEUMD-UHFFFAOYSA-N" target="_blank" rel="nofollow" class="view-more">查看更多</a> </div> <div class="module" id="tongleihuahewu"> <h3 class="module-title"><i class="iconfont icon-tongleihuahewu"></i>同类化合物</h3> <div class="compounds-list"> <a target="_blank" href="https://www.molaid.com/MS_145" class="compound-item" title="(2Z)-1,3-二苯基-2-丙烯-1-酮,2-丙烯-1-酮,1,3-二苯基-,(2Z)-">(2Z)-1,3-二苯基-2-丙烯-1-酮,2-丙烯-1-酮,1,3-二苯基-,(2Z)-</a> <a target="_blank" href="https://www.molaid.com/MS_218" class="compound-item" title="龙血素D">龙血素D</a> <a target="_blank" href="https://www.molaid.com/MS_220" class="compound-item" title="龙血素A">龙血素A</a> <a target="_blank" href="https://www.molaid.com/MS_221" class="compound-item" title="龙血素 B">龙血素 B</a> <a target="_blank" href="https://www.molaid.com/MS_407" class="compound-item" title="黄色当归醇F">黄色当归醇F</a> <a target="_blank" href="https://www.molaid.com/MS_408" class="compound-item" title="黄色当归醇B">黄色当归醇B</a> <a target="_blank" href="https://www.molaid.com/MS_409" class="compound-item" title="黄腐醇; 黄腐酚">黄腐醇; 黄腐酚</a> <a target="_blank" href="https://www.molaid.com/MS_410" class="compound-item" title="黄腐醇 D; 黄腐酚 D">黄腐醇 D; 黄腐酚 D</a> <a target="_blank" href="https://www.molaid.com/MS_411" class="compound-item" title="黄腐酚B">黄腐酚B</a> <a target="_blank" href="https://www.molaid.com/MS_412" class="compound-item" title="黄腐酚">黄腐酚</a> <a target="_blank" href="https://www.molaid.com/MS_413" class="compound-item" title="黄腐酚">黄腐酚</a> <a target="_blank" href="https://www.molaid.com/MS_486" class="compound-item" title="黄卡瓦胡椒素 C">黄卡瓦胡椒素 C</a> <a target="_blank" href="https://www.molaid.com/MS_840" class="compound-item" title="高紫柳查尔酮">高紫柳查尔酮</a> <a target="_blank" href="https://www.molaid.com/MS_3050" class="compound-item" title="阿普非农">阿普非农</a> <a target="_blank" 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src="data:image/svg+xml;base64,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