7-硝基-[1]萘甲酸 | 1975-46-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 中文名称: 7-硝基-[1]萘甲酸
• 英文名称: 7-Nitro-naphthoesaeure-(1)
• 英文别名: 7-Nitronaphthalene-1-carboxylic acid
• CAS: 1975-46-8
• 化学式: C₁₁H₇NO₄
• 分子量: 217.181
• InChiKey: PMUCNPXAAVLXLY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  83.1
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  7-氨基-1-萘甲酸 生成 7-硝基-[1]萘甲酸
  参考文献：
  名称：

  Substituent Effects. II.^1a The Preparation of a Series of Substituted 1-Naphthoic Acids

  摘要：

  DOI：

  10.1021/ja00877a024

文献信息

• The mercury-mediated decarboxylation (Pesci reaction) of naphthoic anhydrides investigated by microwave synthesis
  作者：Jonathan D. Moseley、John P. Gilday

  DOI：10.1016/j.tet.2005.12.064

  日期：2006.5

  The mercury-mediated decarboxylation (Pesci reaction) of several substituted naphthoic anhydrides has been investigated by microwave synthesis. A laboratory microwave reactor was found to be ideal for small-scale preparations of this slow reaction, reducing reaction times from typically four days to less than 1 h for the three-step process. The ionic reaction medium rapidly heated to high temperatures under microwave heating and could be efficiently maintained by low microwave power settings. Generation of stoichiometric CO2 was safely contained within the reaction tubes. A simplified reaction procedure has been developed. For substituted naphthoic anhydrides, H-1 NMR analysis of the naphthoate ester derivatives indicated no change in the regioisomer ratio compared to previously reported thermal values. (c) 2006 Published by Elsevier Ltd.
• Dissociation Constants of Nitronaphthoic Acids¹
  作者：Ernst Berliner、Edith H. Winicov

  DOI：10.1021/ja01516a030

  日期：1959.4