2-methylsulfanyl-hexanol | 148691-00-3

• 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-methylsulfanyl-hexanol
• 英文别名: 2-(Sulfanylmethyl)hexan-1-ol；2-methylsulfanylhexan-1-ol
• CAS: 148691-00-3
• 化学式: C₇H₁₆OS
• 分子量: 148.269
• InChiKey: XFZCXPPCDICCOC-UHFFFAOYSA-N

物化性质

• 沸点：
  230.3±13.0 °C(Predicted)
• 密度：
  0.950±0.06 g/cm3(Predicted)
• 保留指数：
  1217

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  9
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 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：

  2-methylsulfanyl-hexanol 在 二甲基亚砜 、 二异丙胺 、 三氟乙酸酐 作用下， 以 二氯甲烷 为溶剂， 生成 2-methylsulfanyl-hexanal
  参考文献：
  名称：

  Do the Electronic Effects of Sulfur Indeed Control the π-Selectivity of γ-Sulfenyl Enones? An Investigation

  摘要：

  The electronic effects of sulfur in gamma-sulfenyl enones are not transmitted to the carbonyl carbon through the pi bond as reported previously. The diastereoselectivity is rather controlled by a combination of several other factors. The steric effects arising from the substituents on the sulfur atom and the gamma-carbon and the bulk of the nucleophile constitute the major control elements.

  DOI：

  10.1021/jo034608c
• 作为产物：
  描述：

  正己酸乙酯 在 lithium aluminium tetrahydride 、 lithium diisopropyl amide 作用下， 以 四氢呋喃 、 乙醚 为溶剂， 反应 6.17h， 生成 2-methylsulfanyl-hexanol
  参考文献：
  名称：

  Do the Electronic Effects of Sulfur Indeed Control the π-Selectivity of γ-Sulfenyl Enones? An Investigation

  摘要：

  The electronic effects of sulfur in gamma-sulfenyl enones are not transmitted to the carbonyl carbon through the pi bond as reported previously. The diastereoselectivity is rather controlled by a combination of several other factors. The steric effects arising from the substituents on the sulfur atom and the gamma-carbon and the bulk of the nucleophile constitute the major control elements.

  DOI：

  10.1021/jo034608c

文献信息

• System and method of determining proteomic differences
  申请人：——

  公开号：US20030068825A1

  公开（公告）日：2003-04-10

  The present invention relates to a system and methods for identifying differential peptide expression in one or more peptide populations. Each population is labeled with a discernable label and provides a mechanism to resolve mixed peptide populations using mass spectroscopy-based techniques. Spectra produced by the peptide sample are used to interrogate a spectral database in which peptide sequences of known spectra are stored. In addition to providing sequence information, the methods presented herein may be used to determine qualitative and quantitative measurements of peptide expression. These measurements may further be used to determine proteomic differences and novel peptide expression.

  本发明涉及一种在一个或多个肽群中识别不同肽表达的系统和方法。每个肽群都带有可识别的标签，并提供了一种利用质谱技术分辨混合肽群的机制。肽样品产生的光谱可用于查询光谱数据库，该数据库存储了已知光谱的肽序列。除了提供序列信息外，本文介绍的方法还可用于确定肽表达的定性和定量测量。这些测量结果可进一步用于确定蛋白质组差异和新型多肽表达。
• Differential labeling for quantitative analysis of complex protein mixtures
  申请人：——

  公开号：US20030087329A1

  公开（公告）日：2003-05-08

  The present invention relates to a method of simultaneously identifying and determining the levels of expression of cysteine-containing proteins in normal and perturbed cells, a method for proteomic analysis, a process for preparing fusion proteins, and compounds and reagents related thereto.

  本发明涉及一种同时鉴定和确定正常细胞和受干扰细胞中含半胱氨酸蛋白表达水平的方法、一种蛋白质组分析方法、一种制备融合蛋白的工艺以及与之相关的化合物和试剂。
• SYSTEM AND METHOD OF DETERMINING PROTEOMIC DIFFERENCES
  申请人：Syngenta Participations AG

  公开号：EP1428019A2

  公开（公告）日：2004-06-16
• EP1428019A4
  申请人：——

  公开号：EP1428019A4

  公开（公告）日：2006-04-26
• DIFFERENTIAL LABELING FOR QUANTITATIVE ANALYSIS OF COMPLEX PROTEIN MIXTURES BY TRIFUNCTIONAL SYNTHETIC PEPTIDE BASED REAGENTS WITH IODACETAMIDO GROUPS
  申请人：Syngenta Participations AG

  公开号：EP1525483A2

  公开（公告）日：2005-04-27