[(2E)-2-hydroxyiminocyclohexyl] benzoate | 10573-51-0

• 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: [(2E)-2-hydroxyiminocyclohexyl] benzoate
• CAS: 10573-51-0
• 化学式: C₁₃H₁₅NO₃
• 分子量: 233.267
• InChiKey: UWILQUALKOWBNH-SDNWHVSQSA-N

物化性质

• 熔点：
  118-119 °C
• 沸点：
  387.6±35.0 °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)：
  2.7
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  58.9
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  [(2E)-2-hydroxyiminocyclohexyl] benzoate 在 乙醛 作用下， 以86%的产率得到(2-氧代环己基)苯甲酸酯
  参考文献：
  名称：

  Oxidation of bicyclic oxazolines: applications to glycomimetics and novel saccharide derivatives

  摘要：

  A general procedure is reported for the oxidation Of Substituted oxazolines to alpha-acyloxyketoximes and the derived alpha-acyloxyketones. In the case of oxazolines derived from 2-acetamido-2-deoxyhexoses, the resulting 2-oximinoesters can be converted to 2-nitroglycals. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(01)02161-x
• 作为产物：
  描述：

  2-phenyl-3a,4,5,6,7,7a-hexahydro-benzooxazole 在 间氯过氧苯甲酸 作用下， 反应 25.5h， 以51%的产率得到[(2E)-2-hydroxyiminocyclohexyl] benzoate
  参考文献：
  名称：

  Oxidation of bicyclic oxazolines: applications to glycomimetics and novel saccharide derivatives

  摘要：

  A general procedure is reported for the oxidation Of Substituted oxazolines to alpha-acyloxyketoximes and the derived alpha-acyloxyketones. In the case of oxazolines derived from 2-acetamido-2-deoxyhexoses, the resulting 2-oximinoesters can be converted to 2-nitroglycals. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(01)02161-x

文献信息

• Oxidation of bicyclic oxazolines: applications to glycomimetics and novel saccharide derivatives
  作者：Matthew A Clark、Qunzhao Wang、Bruce Ganem

  DOI：10.1016/s0040-4039(01)02161-x

  日期：2002.1

  A general procedure is reported for the oxidation Of Substituted oxazolines to alpha-acyloxyketoximes and the derived alpha-acyloxyketones. In the case of oxazolines derived from 2-acetamido-2-deoxyhexoses, the resulting 2-oximinoesters can be converted to 2-nitroglycals. (C) 2002 Elsevier Science Ltd. All rights reserved.