4-癸基硫烷基苯酚 | 24312-62-7

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 中文名称: 4-癸基硫烷基苯酚
• 英文名称: 4-(decylthio)phenol
• 英文别名: 4-(Decylsulfanyl)phenol；4-decylsulfanylphenol
• CAS: 24312-62-7
• 化学式: C₁₆H₂₆OS
• mdl: MFCD19146103
• 分子量: 266.448
• InChiKey: XQSMAJPLVZVCEX-UHFFFAOYSA-N

物化性质

• 沸点：
  391.8±25.0 °C(Predicted)
• 密度：
  1.00±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  6.6
• 重原子数：
  18
• 可旋转键数：
  10
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.625
• 拓扑面积：
  45.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  4-癸基硫烷基苯酚 在 caesium carbonate 作用下， 以 四氢呋喃 、 N,N-二甲基甲酰胺 为溶剂， 生成 4-[2-[2-(4-Decylsulfanylphenoxy)acetyl]-4-methyl-1,3-thiazol-5-yl]butanoic acid
  参考文献：
  名称：

  Design of novel and potent cPLA2α inhibitors containing an α-methyl-2-ketothiazole as a metabolically stable serine trap

  摘要：

  We report the design of novel, potent cPLA(2)alpha inhibitors that possess an alpha-methyl-2-ketothiazole that acts as a serine-reactive moiety. We describe the optimization of the series for potency and metabolic stability towards ketone reduction. This was achieved by attenuating the reactivity of the ketone using a combination of electronic and steric effects. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.03.005
• 作为产物：
  描述：

  4-溴苯酚 、 1-癸硫醇 在 C₃₀H₃₂Cl₃N₄Ni₂⁽¹⁺⁾*Cl^(1-) 、 potassium hydroxide 作用下， 以 1,4-二氧六环 为溶剂， 反应 6.0h， 以96%的产率得到4-癸基硫烷基苯酚
  参考文献：
  名称：

  C–S交叉耦合中的单核和双核α-二胺镍（II）和钯（II）配合物

  摘要：

  空气和水分的敏感性以及苛刻的反应条件大大降低了过渡金属催化体系在CS交叉偶联反应中的作用。在此，我们报告了用于C–S交叉偶联的四种高度空气和水分稳定的定义明确的单核和桥接双核α-二亚胺Ni（II）和Pd（II）配合物。使用了各种配体构架，包括基于ph和亚氨基吡啶的配体，并评估了催化剂的最终空间性质，并将其与反应结果相关联。在有氧条件和低温下，与以前报道的催化剂相比，Ni和Pd体系均表现出更宽的底物范围和官能团耐受性。由含有烷基，苄基和杂芳基的硫醇合成了40多种化合物。也，从硫醇和卤化物源掺入药学上有活性的杂芳基部分。值得注意的是，通过在广泛的底物范围内提供几乎定量的产率，桥接的双核五坐标Ni络合物的性能优于其余三个单四坐标或六坐标Ni的络合物。

  DOI：

  10.1021/acs.organomet.0c00732

文献信息

• BISPHENOL COMPOSITION AND METHOD FOR PRODUCING SAME, AND POLYCARBONATE RESIN AND METHOD FOR PRODUCING SAME
  申请人：Mitsubishi Chemical Corporation

  公开号：EP3674281A1

  公开（公告）日：2020-07-01

  Provided is a thermally stable bisphenol composition whose increase in the Hazen color number is suppressed even under higher temperature conditions. A bisphenol composition including an aryl alkyl sulfide or a dialkyl disulfide at 0.1 ppb by mass to 1% by mass with respect to a bisphenol. A bisphenol composition including an aryl alkyl sulfide or a dialkyl disulfide at a predetermined ratio is thermally stable in terms of the Hazen color number, and shows no coloring problem under high temperature conditions. By using such a bisphenol composition, a polycarbonate resin having an excellent color tone can be produced.

  本发明提供了一种热稳定性双酚组合物，即使在较高温度条件下，其 Hazen 色数的增加也会受到抑制。一种双酚组合物，包括芳基烷基硫醚或二烷基二硫醚，相对于双酚的质量浓度为 0.1 ppb 至 1%。按预定比例加入芳基烷基硫化物或二烷基二硫化物的双酚组合物在热稳定性方面具有哈森色数，在高温条件下不会出现着色问题。使用这种双酚组合物可以生产出色调极佳的聚碳酸酯树脂。
• NOVEL COMPOUNDS
  申请人：AstraZeneca AB

  公开号：EP1135377A1

  公开（公告）日：2001-09-26
• [EN] NOVEL COMPOUNDS<br/>[FR] NOUVEAUX COMPOSES
  申请人：ASTRAZENECA UK LTD

  公开号：WO2000034254A1

  公开（公告）日：2000-06-15

  Compounds of formula (I) are disclosed, processes for their preparation, pharmaceutical compositions containing the compounds and the use of the compounds as pharmaceuticals. There are also provided chemical intermediates useful for the preparation of the compounds. The compounds are useful as pharmaceuticals, especially for the treatment of inflammatory disease.
• Mono- and Dinuclear α-Diimine Nickel(II) and Palladium(II) Complexes in C–S Cross-Coupling
  作者：Md Muktadir Talukder、Justin T. Miller、John Michael O. Cue、Chinthaka M. Udamulle、Abhi Bhadran、Michael C. Biewer、Mihaela C. Stefan

  DOI：10.1021/acs.organomet.0c00732

  日期：2021.1.11

  significantly reduced by air and moisture sensitivity, as well as harsh reaction conditions. Herein, we report four highly air- and moisture-stable well-defined mononuclear and bridged dinuclear α-diimine Ni(II) and Pd(II) complexes for C–S cross-coupling. Various ligand frameworks, including acenaphthene- and iminopyridine-based ligands, were employed, and the resulting steric properties of the catalysts were

  空气和水分的敏感性以及苛刻的反应条件大大降低了过渡金属催化体系在CS交叉偶联反应中的作用。在此，我们报告了用于C–S交叉偶联的四种高度空气和水分稳定的定义明确的单核和桥接双核α-二亚胺Ni（II）和Pd（II）配合物。使用了各种配体构架，包括基于ph和亚氨基吡啶的配体，并评估了催化剂的最终空间性质，并将其与反应结果相关联。在有氧条件和低温下，与以前报道的催化剂相比，Ni和Pd体系均表现出更宽的底物范围和官能团耐受性。由含有烷基，苄基和杂芳基的硫醇合成了40多种化合物。也，从硫醇和卤化物源掺入药学上有活性的杂芳基部分。值得注意的是，通过在广泛的底物范围内提供几乎定量的产率，桥接的双核五坐标Ni络合物的性能优于其余三个单四坐标或六坐标Ni的络合物。
• Design of novel and potent cPLA2α inhibitors containing an α-methyl-2-ketothiazole as a metabolically stable serine trap
  作者：Antonio Mete、Glen Andrews、Mike Bernstein、Stephen Connolly、Paul Hartopp、Clive G. Jackson、Richard Lewis、Iain Martin、David Murray、Rob Riley、David H. Robinson、Gill M. Smith、Edward Wells、W. John Withnall

  DOI：10.1016/j.bmcl.2011.03.005

  日期：2011.5

  We report the design of novel, potent cPLA(2)alpha inhibitors that possess an alpha-methyl-2-ketothiazole that acts as a serine-reactive moiety. We describe the optimization of the series for potency and metabolic stability towards ketone reduction. This was achieved by attenuating the reactivity of the ketone using a combination of electronic and steric effects. (C) 2011 Elsevier Ltd. All rights reserved.