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tert-butyl 2-(4-(2,2,2-trifluoroacetyl)phenoxy)acetate | 1351283-01-6

中文名称
——
中文别名
——
英文名称
tert-butyl 2-(4-(2,2,2-trifluoroacetyl)phenoxy)acetate
英文别名
——
tert-butyl 2-(4-(2,2,2-trifluoroacetyl)phenoxy)acetate化学式
CAS
1351283-01-6
化学式
C14H15F3O4
mdl
——
分子量
304.266
InChiKey
RAAHHHKSXOTOCJ-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    3.15
  • 重原子数:
    21.0
  • 可旋转键数:
    4.0
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.43
  • 拓扑面积:
    52.6
  • 氢给体数:
    0.0
  • 氢受体数:
    4.0

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    tert-butyl 2-(4-(2,2,2-trifluoroacetyl)phenoxy)acetate吡啶盐酸羟胺 作用下, 反应 0.67h, 以90%的产率得到tert-butyl 2-(4-(2,2,2-trifluoro-1-(hydroxyimino)ethyl)phenoxy)acetate
    参考文献:
    名称:
    A generic small-molecule microarray immobilization strategy
    摘要:
    Small-molecule microarrays are often limited by the requirement for each compound undergoing immobilization to contain a common functional group or by the need to prepare glass slides containing photo-reactive groups. Herein, we present a generic strategy that allows any compound library to be immobilized. This was achieved by printing a fluorous-tagged photo-reactive 3-aryl-3-trifluoromethyldiazirine, which undergoes non-selective insertion into compounds following UV-activation, onto fluorous-functionalized glass slides. The arrays could be reused following aqueous stripping and re-assessment of the compounds with the same protein or another target of interest. Crown Copyright (C) 2011 Published by Elsevier Ltd. All rights reserved.
    DOI:
    10.1016/j.tetlet.2011.10.055
  • 作为产物:
    描述:
    4-溴苯酚正丁基锂potassium carbonate三乙胺 、 potassium iodide 作用下, 以 四氢呋喃乙腈 为溶剂, 反应 0.67h, 生成 tert-butyl 2-(4-(2,2,2-trifluoroacetyl)phenoxy)acetate
    参考文献:
    名称:
    A generic small-molecule microarray immobilization strategy
    摘要:
    Small-molecule microarrays are often limited by the requirement for each compound undergoing immobilization to contain a common functional group or by the need to prepare glass slides containing photo-reactive groups. Herein, we present a generic strategy that allows any compound library to be immobilized. This was achieved by printing a fluorous-tagged photo-reactive 3-aryl-3-trifluoromethyldiazirine, which undergoes non-selective insertion into compounds following UV-activation, onto fluorous-functionalized glass slides. The arrays could be reused following aqueous stripping and re-assessment of the compounds with the same protein or another target of interest. Crown Copyright (C) 2011 Published by Elsevier Ltd. All rights reserved.
    DOI:
    10.1016/j.tetlet.2011.10.055
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