(2-ethyl-phenylsulfanyl)-acetic acid | 74266-24-3

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: (2-ethyl-phenylsulfanyl)-acetic acid
• 英文别名: (2-Aethyl-phenylmercapto)-essigsaeure；2-(2-Ethylphenyl)sulfanylacetic acid
• CAS: 74266-24-3
• 化学式: C₁₀H₁₂O₂S
• 分子量: 196.27
• InChiKey: BFQMUIAZJOHPNG-UHFFFAOYSA-N

物化性质

• 沸点：
  330.0±35.0 °C(Predicted)
• 密度：
  1.19±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  13
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  62.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  (2-ethyl-phenylsulfanyl)-acetic acid 在 哌啶 、 氯化亚砜 作用下， 以 甲苯 为溶剂， 反应 1.0h， 生成 Z-2-(3,4,5-trifluorophenyl)methylene-7-ethylbenzo[b]thiophen-3(2H)-one
  参考文献：
  名称：

  Novel photoinduced cyclization of pentafluorophenylhemithioindigo

  摘要：

  Photoirradiation of the pentafluorophenyl-substituted Z-hemithioindigo 1 causes a novel type of photoinduced cyclization, to produce the intramolecularly cyclized alcohol 2 and its dehydrated ether 3. For this photoinduced cyclization, the o-fluorine atoms of the phenyl group of 1 are found to be crucial. (C) 2007 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2007.03.019
• 作为产物：
  描述：

  2-乙基苯硫酚 、 溴乙酸 生成 (2-ethyl-phenylsulfanyl)-acetic acid
  参考文献：
  名称：

  Novel photoinduced cyclization of pentafluorophenylhemithioindigo

  摘要：

  Photoirradiation of the pentafluorophenyl-substituted Z-hemithioindigo 1 causes a novel type of photoinduced cyclization, to produce the intramolecularly cyclized alcohol 2 and its dehydrated ether 3. For this photoinduced cyclization, the o-fluorine atoms of the phenyl group of 1 are found to be crucial. (C) 2007 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2007.03.019

文献信息

• Oxidative cleavage of S-arylmercaptoacetic acids by sodium perborate: Kinetic and correlation study
  作者：S. Kabilan、K. Pandiarajan、K. Krishnasamy、P. Sankar

  DOI：10.1002/kin.550270504

  日期：1995.5

  AbstractKinetics of oxidation of twenty six S‐arylmercaptoacetic acids (SAMA) (I) by sodium perborate (PB) have been studied in acid medium. The product of oxidation is the corresponding thiophenol. The rate data of meta‐and para‐substituted acids have been correlated with DSP equations. While the para‐compounds correlate well with σI and σR° values, the meta‐compounds correlate well with σI and σ values. The reaction constants are negative and of smaller magnitudes. Further, the ortho‐substituted acids show a good correlation with a triparametric equation involving Taft's σI and R° and Charton's steric parameter ν. There is a considerable steric contribution to the total ortho‐substituent effect. Based on these observations, mechanism involving the formation of protonated arylsulfinylacetic acid intermediate, followed by an intramolecular rearrangement leading to the product thiophenol has been proposed. © 1995 John Wiley & Sons, Inc.
• Discovery of Novel UDP-<i>N</i>-Acetylglucosamine Acyltransferase (LpxA) Inhibitors with Activity against <i>Pseudomonas aeruginosa</i>
  作者：M. Dominic Ryan、Alastair L. Parkes、David Corbett、Anthony P. Dickie、Michelle Southey、Ole A. Andersen、Daniel B. Stein、Olivier R. Barbeau、Angelo Sanzone、Pia Thommes、John Barker、Ricky Cain、Christel Compper、Magali Dejob、Alain Dorali、Donnya Etheridge、Sian Evans、Adele Faulkner、Elise Gadouleau、Timothy Gorman、Denes Haase、Maisie Holbrow-Wilshaw、Thomas Krulle、Xianfu Li、Christopher Lumley、Barbara Mertins、Spencer Napier、Rajesh Odedra、Kostas Papadopoulos、Vasileios Roumpelakis、Kate Spear、Emily Trimby、Jennifer Williams、Michael Zahn、Anthony D. Keefe、Ying Zhang、Holly T. Soutter、Paolo A. Centrella、Matthew A. Clark、John W. Cuozzo、Christoph E. Dumelin、Boer Deng、Avery Hunt、Eric A. Sigel、Dawn M. Troast、Boudewijn L. M. DeJonge

  DOI：10.1021/acs.jmedchem.1c00888

  日期：2021.10.14
• Oksengendler; Losinskii, Ukrainskij Khimicheskij Zhurnal, 1959, vol. 25, p. 95,97
  作者：Oksengendler、Losinskii

  DOI：——

  日期：——
• CABIDDU S.; MELIS S.; PIRAS P. P.; SOTGIU F., J. ORGANOMETAL. CHEM., 1979, 178, NO 2, 291-300
  作者：CABIDDU S.、 MELIS S.、 PIRAS P. P.、 SOTGIU F.

  DOI：——

  日期：——
• SPONTANEOUS-EMISSION TYPE PHOTOSENSITIVE RESIN COMPOSITION, COLOR FILTER MANUFACTURED USING SAME, AND IMAGE DISPLAY APPARATUS
  申请人：DONGWOO FINE-CHEM CO., LTD.

  公开号：US20190278173A1

  公开（公告）日：2019-09-12

  According to the present invention, a spontaneous-emission type photosensitive resin composition comprises a cardo-based binder resin comprising at least one repeating unit of chemical formula 1 to chemical formula 4.