N-(1,2,2,3,3,4,4,5,5,6,6-undecadeuteriocyclohexyl)acetamide | 1356999-97-7

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: N-(1,2,2,3,3,4,4,5,5,6,6-undecadeuteriocyclohexyl)acetamide
• CAS: 1356999-97-7
• 化学式: C₈H₁₅NO
• 分子量: 152.126
• InChiKey: WRAGCBBWIYQMRF-GGVNHIDCSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  10
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  29.1
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  环己烷 、 全氘代环己烷 、 乙腈 在 zinc trifluoromethanesulfonate 、 1-(chloromethyl)-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane bis(hexafluorophosphate) 、 copper(ll) bromide 、 sodium hydroxide 作用下， 以 水 为溶剂， 反应 0.08h， 生成 N-环己基乙酰胺 、 N-(1,2,2,3,3,4,4,5,5,6,6-undecadeuteriocyclohexyl)acetamide
  参考文献：
  名称：

  Intermolecular Ritter-Type C–H Amination of Unactivated sp³Carbons

  摘要：

  Intermolecular Ritter-type C-H amination of unactivated sp(3) carbons has been developed. This new reaction proceeds under mild conditions using readily available reagents and an inexpensive source of nitrogen (acetonitrile). A broad scope of substrates can be aminated with this method since many functional groups are tolerated. This reaction also allows for the direct, innate C H amination of a variety of hydrocarbons such as cyclohexane without the need of prefunctionalization or installation of a directing group.

  DOI：

  10.1021/ja212020b

文献信息

• INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION
  申请人：YOAKIM CHRISTIANE

  公开号：US20100292227A1

  公开（公告）日：2010-11-18

  Compounds of formula I: wherein a, R 1 , R 2 , R 3 , R 4 , R 5 and R 6 are defined herein, are useful as inhibitors of HIV replication.
• US8338441B2
  申请人：——

  公开号：US8338441B2

  公开（公告）日：2012-12-25
• Intermolecular Ritter-Type C–H Amination of Unactivated sp³Carbons
  作者：Quentin Michaudel、Damien Thevenet、Phil S. Baran

  DOI：10.1021/ja212020b

  日期：2012.2.8

  Intermolecular Ritter-type C-H amination of unactivated sp(3) carbons has been developed. This new reaction proceeds under mild conditions using readily available reagents and an inexpensive source of nitrogen (acetonitrile). A broad scope of substrates can be aminated with this method since many functional groups are tolerated. This reaction also allows for the direct, innate C H amination of a variety of hydrocarbons such as cyclohexane without the need of prefunctionalization or installation of a directing group.