2-bromo-N-(2-hydroxyethyl)-N-methylbenzamide | 944065-51-4

• 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: 2-bromo-N-(2-hydroxyethyl)-N-methylbenzamide
• CAS: 944065-51-4
• 化学式: C₁₀H₁₂BrNO₂
• mdl: MFCD10049136
• 分子量: 258.115
• InChiKey: VVLOLSGMIVLWPE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  40.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-bromo-N-(2-hydroxyethyl)-N-methylbenzamide 在 aluminium hydride 作用下， 以 四氢呋喃 为溶剂， 以52%的产率得到N-(2-bromobenzyl)-N-methylethanolamine
  参考文献：
  名称：

  An efficient optical resolution of nitrogen-centered chiral β-hydroxy-tetraalkylammonium salts via complexation with (R)-BINOL

  摘要：

  The optical resolution of nitrogen-centered chiral beta-hydroxy-tetraalkylammonium bromides is demonstrated by using chiral BINOL as a complexing agent. Determination of the enantiopurities and absolute configurations of the resolved N-chiral tetraalkylammonium salts are described. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2007.04.078
• 作为产物：
  描述：

  N-甲基-2-羟基乙胺 、 2-溴苯甲酰氯 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 以86%的产率得到2-bromo-N-(2-hydroxyethyl)-N-methylbenzamide
  参考文献：
  名称：

  An efficient optical resolution of nitrogen-centered chiral β-hydroxy-tetraalkylammonium salts via complexation with (R)-BINOL

  摘要：

  The optical resolution of nitrogen-centered chiral beta-hydroxy-tetraalkylammonium bromides is demonstrated by using chiral BINOL as a complexing agent. Determination of the enantiopurities and absolute configurations of the resolved N-chiral tetraalkylammonium salts are described. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2007.04.078

文献信息

• An efficient optical resolution of nitrogen-centered chiral β-hydroxy-tetraalkylammonium salts via complexation with (R)-BINOL
  作者：Eiji Tayama、Hiroyuki Tanaka

  DOI：10.1016/j.tetlet.2007.04.078

  日期：2007.6

  The optical resolution of nitrogen-centered chiral beta-hydroxy-tetraalkylammonium bromides is demonstrated by using chiral BINOL as a complexing agent. Determination of the enantiopurities and absolute configurations of the resolved N-chiral tetraalkylammonium salts are described. (c) 2007 Elsevier Ltd. All rights reserved.