1-(2-Methyl-1-phenylpropan-2-yl)oxysulfanyl-4-nitrobenzene | 159106-42-0

• 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: 1-(2-Methyl-1-phenylpropan-2-yl)oxysulfanyl-4-nitrobenzene
• CAS: 159106-42-0
• 化学式: C₁₆H₁₇NO₃S
• 分子量: 303.382
• InChiKey: UZTDWKTVKPPFPK-UHFFFAOYSA-N

物化性质

• 沸点：
  442.5±55.0 °C(predicted)
• 密度：
  1.22±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  21
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  80.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1-(2-Methyl-1-phenylpropan-2-yl)oxysulfanyl-4-nitrobenzene 、 3-甲基-1,2-丁二烯 生成 1-[2,7-Dimethyl-6-(4-nitrophenyl)sulfanylocta-2,6-dien-3-yl]sulfanyl-4-nitrobenzene
  参考文献：
  名称：

  Pasto Daniel J., Cottard Francois, J. Org. Chem, 59 (1994) N 16, S 4642-4646

  摘要：

  DOI：
• 作为产物：
  描述：

  4-硝基苯亚磺酰氯 、 二甲基苄基原醇 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成 1-(2-Methyl-1-phenylpropan-2-yl)oxysulfanyl-4-nitrobenzene
  参考文献：
  名称：

  A Study of the Regioselectivity of the Radical Addition of "RSAr" Derived from the Photolysis of tert-Homoallyl and tert-Alkyl 4-Nitrobenzenesulfenates to Substituted Allenes and Alkenes

  摘要：

  The regioselectivity of the free radical addition of ''RSAr'' derived from the photolysis of tert-homoallyl and tert-alkyl 4-nitrobenzenesulfenates, followed by beta-scission of the alkoxy radicals to produce the allyl or alkyl radicals R. to 1,1- and 1,3-dimethylallene and acrylonitrile and methyl acrylate has been determined. The regioselectivity of addition of ''RSAr'' to 1,1- and 1,3-dimethylallene occurs by the addition of the arylthiyl radical to the-center carbon atom of the allene chromophore, whereas the regioselectivity of the addition to acrylonitrile and methyl acrylate varies with the nature of the R.. The results are interpreted in terms of the relative reactivities of the pi systems toward radical addition and the relative rates of beta-scission of the intermediate alkoxy radicals versus the rates of addition of the 4-nitrobenzenethiyl radical and R. to the pi systems.

  DOI：

  10.1021/jo00095a045

文献信息

• Pasto Daniel J., Cottard Francois, J. Org. Chem, 59 (1994) N 16, S 4642-4646
  作者：Pasto Daniel J., Cottard Francois

  DOI：——

  日期：——
• A Study of the Regioselectivity of the Radical Addition of "RSAr" Derived from the Photolysis of tert-Homoallyl and tert-Alkyl 4-Nitrobenzenesulfenates to Substituted Allenes and Alkenes
  作者：Daniel J. Pasto、Francois Cottard

  DOI：10.1021/jo00095a045

  日期：1994.8

  The regioselectivity of the free radical addition of ''RSAr'' derived from the photolysis of tert-homoallyl and tert-alkyl 4-nitrobenzenesulfenates, followed by beta-scission of the alkoxy radicals to produce the allyl or alkyl radicals R. to 1,1- and 1,3-dimethylallene and acrylonitrile and methyl acrylate has been determined. The regioselectivity of addition of ''RSAr'' to 1,1- and 1,3-dimethylallene occurs by the addition of the arylthiyl radical to the-center carbon atom of the allene chromophore, whereas the regioselectivity of the addition to acrylonitrile and methyl acrylate varies with the nature of the R.. The results are interpreted in terms of the relative reactivities of the pi systems toward radical addition and the relative rates of beta-scission of the intermediate alkoxy radicals versus the rates of addition of the 4-nitrobenzenethiyl radical and R. to the pi systems.