1-(1-Hydroxycyclohexyl)cycloheptan-1-ol | 73223-33-3

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-(1-Hydroxycyclohexyl)cycloheptan-1-ol
• CAS: 73223-33-3
• 化学式: C₁₃H₂₄O₂
• 分子量: 212.332
• InChiKey: BLIGWUKWTFHZCC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  40.5
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-(1-Hydroxycyclohexyl)cycloheptan-1-ol 在 硫酸 作用下， 反应 2.0h， 以100%的产率得到1-(Cyclohexen-1-yl)cycloheptene
  参考文献：
  名称：

  Study of I-Strain Relief in the Intermediate When Forming Spiro Ketones from Unsymmetrical Cycloalkylidenecycloalkanes, Their Dibromides, and Their Pinacols

  摘要：

  Three unsymmetrical intercyclic olefins, their dibromides, and their pinacols were prepared, each so the two carbons involved at the functional group were part of a different sized ring. The pinacols were reacted with 25% sulfuric acid and with boron trifluoride etherate, the dibromides with silver nitrate,and the olefins with mercuric acetate and with trifluoroperacetic acid. The predominant spiro ketone found in each product mixture was used to determine which carbon, and hence which size ring, could better undergo the sp(3) to sp(2) or the sp(2) to sp(3) transition. The findings were consistent with Brown's observations on ring strain.

  DOI：

  10.1021/jo00081a030
• 作为产物：
  描述：

  环己酮 、 环庚酮 在 氢化铝 作用下， 以28.9%的产率得到1,1-二羟基双环己基
  参考文献：
  名称：

  Study of I-Strain Relief in the Intermediate When Forming Spiro Ketones from Unsymmetrical Cycloalkylidenecycloalkanes, Their Dibromides, and Their Pinacols

  摘要：

  Three unsymmetrical intercyclic olefins, their dibromides, and their pinacols were prepared, each so the two carbons involved at the functional group were part of a different sized ring. The pinacols were reacted with 25% sulfuric acid and with boron trifluoride etherate, the dibromides with silver nitrate,and the olefins with mercuric acetate and with trifluoroperacetic acid. The predominant spiro ketone found in each product mixture was used to determine which carbon, and hence which size ring, could better undergo the sp(3) to sp(2) or the sp(2) to sp(3) transition. The findings were consistent with Brown's observations on ring strain.

  DOI：

  10.1021/jo00081a030

文献信息

• [EN] PROCESS FOR UPGRADING HYDROCARBON FUELS
  申请人：——

  公开号：WO1984002716A1

  公开（公告）日：1984-07-19

  (EN) Hydrocarbon fuels, for example straight run gasoline and cat-cracked spirit, are up-graded by reacting the fuel with a hydrocarbyl hydroperoxide at a temperature greater than the decomposition temperature of the hydroperoxide and at a pressure sufficient to maintain the reactants in the liquid phase. The reaction may be carried out in the presence or absence of a metal catalyst for the decomposition of the hydroperoxide and optionally in the presence of a solid not generally regarded as a hydroperoxide decomposition catalyst, e.g. alumina, silica or silica-alumina. (FR) La qualité de combustibles d"hydrocarbures, par exemple de l"essence produite directement par distillation de pétrole brut, ou une essence obtenue par craquage catalytique d"un hydrocarbure lourd, est améliorée en faisant réagir le combustible avec un hydropéroxyde d"hydrocarbyle à une température supérieure à la température de décomposition de l"hydropéroxyde et à une pression suffisante pour maintenir les réactifs dans la phase liquide. La réaction peut se dérouler en présence ou en l"absence d"un catalyseur métallique pour la décomposition de l"hydropéroxyde et, éventuellement, en présence d"un solide pas toujours considéré comme un catalyseur de décomposition de l"hydropéroxyde, par exemple l"alumine, la silice ou la silice-alumine.
• Study of I-Strain Relief in the Intermediate When Forming Spiro Ketones from Unsymmetrical Cycloalkylidenecycloalkanes, Their Dibromides, and Their Pinacols
  作者：Richard D. Sands

  DOI：10.1021/jo00081a030

  日期：1994.1

  Three unsymmetrical intercyclic olefins, their dibromides, and their pinacols were prepared, each so the two carbons involved at the functional group were part of a different sized ring. The pinacols were reacted with 25% sulfuric acid and with boron trifluoride etherate, the dibromides with silver nitrate,and the olefins with mercuric acetate and with trifluoroperacetic acid. The predominant spiro ketone found in each product mixture was used to determine which carbon, and hence which size ring, could better undergo the sp(3) to sp(2) or the sp(2) to sp(3) transition. The findings were consistent with Brown's observations on ring strain.