2-(o-methylphenylmethoxy)acetylchloride | 1214741-87-3

• 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-(o-methylphenylmethoxy)acetylchloride
• 英文别名: 2-[(2-Methylphenyl)methoxy]acetyl chloride
• CAS: 1214741-87-3
• 化学式: C₁₀H₁₁ClO₂
• 分子量: 198.649
• InChiKey: CFUKYUILRQZVKJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  13
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-(4-aminophenyl)-1,3-benzoxazole-5-carbonitrile 、 2-(o-methylphenylmethoxy)acetylchloride 在 N,N-二异丙基乙胺 作用下， 以 二氯甲烷 为溶剂， 生成 N-(4-(5-cyanobenzo[d]oxazol-2-yl)phenyl)-2-(2-methylbenzyloxy)acetamide
  参考文献：
  名称：

  2-Arylbenzoxazoles as CETP inhibitors: Substitution and modification of the α-alkoxyamide moiety

  摘要：

  The development of a series of 2-arylbenzoxazole alpha-alkoxyamide and beta-alkoxyamine inhibitors of cholesteryl ester transfer protein (CETP) is described. Highly fluorinated alpha-alkoxyamides proved to be potent inhibitors of CETP in vitro, and the highly fluorinated 2-arylbenzoxazole beta-alkoxyamine 4 showed a desirable combination of in vitro potency (IC(50) = 151 nM) and oral bioavailability in the mouse. (c) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.12.046
• 作为产物：
  描述：

  2-[(2-Methylphenyl)methoxy]acetic acid 在 草酰氯 作用下， 以 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 生成 2-(o-methylphenylmethoxy)acetylchloride
  参考文献：
  名称：

  2-Arylbenzoxazoles as CETP inhibitors: Substitution and modification of the α-alkoxyamide moiety

  摘要：

  The development of a series of 2-arylbenzoxazole alpha-alkoxyamide and beta-alkoxyamine inhibitors of cholesteryl ester transfer protein (CETP) is described. Highly fluorinated alpha-alkoxyamides proved to be potent inhibitors of CETP in vitro, and the highly fluorinated 2-arylbenzoxazole beta-alkoxyamine 4 showed a desirable combination of in vitro potency (IC(50) = 151 nM) and oral bioavailability in the mouse. (c) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.12.046

文献信息

• US6359174B1
  申请人：——

  公开号：US6359174B1

  公开（公告）日：2002-03-19
• US6552226B1
  申请人：——

  公开号：US6552226B1

  公开（公告）日：2003-04-22
• [EN] TANDEM ACYL-CLAISEN REARRANGEMENT IN THE PREPARATION OF CHIRAL PRODUCTS<br/>[FR] REARRANGEMENT EN TANDEM ACYLE-CLAISEN DANS LA PREPARATION DE PRODUITS CHIRAUX
  申请人：UNIV CALIFORNIA

  公开号：WO2002026683A1

  公开（公告）日：2002-04-04

  A novel tandem acyl-Claisen rearrangement reaction is provided. An allylic reactant such as an allylic amine or an allylic thioether, having at least two functional groups that enable the reactant to undergo at least two successive Claisen rearrangement reactions, is reacted with an acid chloride in the presence of a Lewis acid catalyst composition composed of a Lewis acid and a second catalyst component selected from the group consisting of tertiary amines and non-nitrogenous bases. The stereochemistry of the reaction product is readily controlled by the positioning and size of substituents on the allylic reactant. The reaction may be carried out on a solid support, i.e., on the surface of a substrate suitable for conducting solid phase chemical reactions.