(3-bromo-4-methoxyphenyl)(4-chlorophenyl)methanone | 81224-20-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (3-bromo-4-methoxyphenyl)(4-chlorophenyl)methanone
• 英文别名: bromo-3 methoxy-4 p-chlorobenzophenone；(3-Bromo-4-methoxyphenyl)-(4-chlorophenyl)methanone
• CAS: 81224-20-6
• 化学式: C₁₄H₁₀BrClO₂
• mdl: MFCD11545548
• 分子量: 325.589
• InChiKey: NTJVOSQQORMQPJ-UHFFFAOYSA-N

物化性质

• 熔点：
  120 °C
• 沸点：
  430.6±45.0 °C(Predicted)
• 密度：
  1.482±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.071
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (3-bromo-4-methoxyphenyl)(4-chlorophenyl)methanone 在 CuO/Cr₂O₃ 正丁基锂 、 sodium methylate 、 对甲苯磺酸 作用下， 以 喹啉 、 甲醇 、 氢氧化钾 、 xylene 、 苯 为溶剂， 反应 71.5h， 生成 p-chlorobenzoyl-7 methoxy-4 indole
  参考文献：
  名称：

  Kim, Phieo Ta; Guillard, Roger; Samreth, Soth, Journal of Heterocyclic Chemistry, 1981, vol. 18, p. 1373 - 1377

  摘要：

  DOI：
• 作为产物：
  描述：

  1-(4-chlorobenzyl)-4-methoxybenzene 在 N-溴代丁二酰亚胺(NBS) 、 水 作用下， 以 氯仿 为溶剂， 反应 3.0h， 以44%的产率得到(3-bromo-4-methoxyphenyl)(4-chlorophenyl)methanone
  参考文献：
  名称：

  Synthesis of structurally diverse diarylketones through the diarylmethyl sp3 CH oxidation

  摘要：

  Under open-flask conditions, an efficient method to assemble a series of diversely functionalized diarylketones in the presence of commercially available NBS has been developed. Yields of up to 99% have been achieved employing diarylmethanes as starting material. Based on O-18-labeled experiment, the addition of stoichiometric water eventually leads to excellent yields in all carbonylation cases. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2014.06.047

文献信息

• Catalytic Friedel–Crafts acylation: magnetic nanopowder CuFe2O4 as an efficient and magnetically separable catalyst
  作者：Ramarao Parella、Naveen、Amit Kumar、Srinivasarao Arulananda Babu

  DOI：10.1016/j.tetlet.2013.01.081

  日期：2013.3

  Catalytic regioselective Friedel-Crafts acylation of an array of anisoles/arenes with various acid chlorides using 5-20 mol % of magnetic nanopowder CuFe2O4 is reported. Unlike the conventional Friedel-Crafts reactions, which are catalyzed by moisture sensitive homogeneous catalysts/promoters, the nanopowder CuFe2O4 catalyst is moisture insensitive and the product/ketone-catalyst isolation is easily achieved using the magnetic properties of CuFe2O4. (C) 2013 Elsevier Ltd. All rights reserved.
• KIM, PHIEO, TA;GUILARD, R.;SAMRETH, S.;SORNAY, R., J. HETEROCYCL. CHEM., 1981, 18, N 7, 1373-1377
  作者：KIM, PHIEO, TA、GUILARD, R.、SAMRETH, S.、SORNAY, R.

  DOI：——

  日期：——
• Synthesis of structurally diverse diarylketones through the diarylmethyl sp3 CH oxidation
  作者：Chao He、Xiaohui Zhang、Ruofeng Huang、Jing Pan、Jiaqiang Li、Xuege Ling、Yan Xiong、Xiangming Zhu

  DOI：10.1016/j.tetlet.2014.06.047

  日期：2014.8

  Under open-flask conditions, an efficient method to assemble a series of diversely functionalized diarylketones in the presence of commercially available NBS has been developed. Yields of up to 99% have been achieved employing diarylmethanes as starting material. Based on O-18-labeled experiment, the addition of stoichiometric water eventually leads to excellent yields in all carbonylation cases. (C) 2014 Elsevier Ltd. All rights reserved.
• Kim, Phieo Ta; Guillard, Roger; Samreth, Soth, Journal of Heterocyclic Chemistry, 1981, vol. 18, p. 1373 - 1377
  作者：Kim, Phieo Ta、Guillard, Roger、Samreth, Soth、Sornay, Roland

  DOI：——

  日期：——