methyl 6-isopropenyl-2-naphthoate | 958332-47-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: methyl 6-isopropenyl-2-naphthoate
• 英文别名: methyl 6-(prop-1-en-2-yl)-2-naphthoate；Methyl 6-(prop-1-en-2-yl)-2-naphthoate；methyl 6-prop-1-en-2-ylnaphthalene-2-carboxylate
• CAS: 958332-47-3
• 化学式: C₁₅H₁₄O₂
• 分子量: 226.275
• InChiKey: WIDRXQDHTTVBDX-UHFFFAOYSA-N

物化性质

• 沸点：
  354.5±11.0 °C(Predicted)
• 密度：
  1.091±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.13
• 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：

  methyl 6-isopropenyl-2-naphthoate 在 水 、 diethylzinc 、 sodium hydroxide 作用下， 以 甲醇 、 正己烷 、 1,2-二氯乙烷 为溶剂， 反应 22.0h， 生成 6-(1-methylcyclopropyl)-2-naphthoic acid
  参考文献：
  名称：

  AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME

  摘要：

  披露了具有以下公式表示的化合物：公式（I）。这些化合物可以制备为药物组合物，并可用于预防和治疗包括人类在内的哺乳动物的各种疾病，例如疼痛、炎症、创伤性损伤等。

  公开号：

  US20120088746A1
• 作为产物：
  描述：

  methyl 6-acetyle-2-naphtoate 在 potassium tert-butylate 作用下， 以 四氢呋喃 为溶剂， 反应 3.5h， 以88%的产率得到methyl 6-isopropenyl-2-naphthoate
  参考文献：
  名称：

  WO2008/7211

  摘要：

  公开号：

文献信息

• SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS
  申请人：Kawashima Tadashi

  公开号：US20090253740A1

  公开（公告）日：2009-10-08

  This invention provides a compound of the formula (I): And their use for the treatment of disease conditions caused by overactivation of the VR1 receptor such as pain, or the like in mammal. This invention also provides a pharmaceutical composition comprising the above compound.

  本发明提供了一个公式(I)的化合物，以及它们用于治疗由VR1受体过度激活引起的疾病状态，如哺乳动物中的疼痛等。本发明还提供了包含上述化合物的药物组合物。
• Substituted bicyclocarboxyamide compounds
  申请人：Pfizer Inc.

  公开号：US07964732B2

  公开（公告）日：2011-06-21

  This invention provides a compound of the formula These compounds are useful for the treatment of disease conditions caused by overactivation of the VR1 receptor such as pain, or the like in mammal. This invention also provides a pharmaceutical composition comprising the above compound.

  这项发明提供了一个公式的化合物。这些化合物对于治疗由VR1受体过度激活引起的疾病状况，例如哪些在哺乳动物中引起疼痛等方面是有用的。该发明还提供了包括上述化合物的制药组合物。
• Substituted Bicyclocarboxyamide Compounds
  申请人：Ando Koji

  公开号：US20100267769A1

  公开（公告）日：2010-10-21

  This invention provides a compound of the formula These compounds are useful for the treatment of disease conditions caused by overactivation of the VR1 receptor such as pain, or the like in mammal. This invention also provides a pharmaceutical composition comprising the above compound.

  本发明提供了一个化合物的公式，该化合物对于治疗由VR1受体过度活化引起的疾病状态，如哮喘等哺乳动物中的疼痛等疾病状态非常有用。本发明还提供了一种包含上述化合物的药物组合物。
• Substituted N-bicyclicalkyl bicycliccarboxyamide compounds
  申请人：Pfizer Inc.

  公开号：US08134004B2

  公开（公告）日：2012-03-13

  This invention provides a compound of the formula (I): And their use for the treatment of disease conditions caused by overactivation of the VR1 receptor such as pain, or the like in mammal. This invention also provides a pharmaceutical composition comprising the above compound.

  本发明提供了一种化合物（I）的配方，以及它们在哺乳动物中治疗由VR1受体过度激活引起的疾病状况（如疼痛等）的用途。本发明还提供了包括上述化合物的药物组合物。
• Synthesis of 6-hydroxy-2-naphthoic acid from 2,6-diisopropylnaphthalene using NHPI as a key catalyst
  作者：Ryota Nakamura、Yasushi Obora、Yasutaka Ishii

  DOI：10.1016/j.tet.2009.03.013

  日期：2009.5

  A new strategy to 6-hydroxy-2-naphthoic acid (HNPA) and 4-hydroxybenzoic acid from 2,6-diisopropylnaphthalene and p-cymene, respectively, was developed using the NHPI-catalyzed aerobic oxidation as a principal reaction. 2,6-Diisopropylnaphthalene was oxidized by the oxidation with O-2 (1 atm) by NHPI (10 mol %) combined with Co(OAc)(2) (0.5 mol %) to give 6-acetyl-2 -isopropylnaphthalene, which then was converted to 6-isopropyl-2-naphthoic acid Under O-2 (1 atm) in the presence of Co(OAc)(2) (0.5 mol %) and Mn(OAc)(2) (0.5 mol %), Esterification of the resulting acid followed by the aerobic oxidation produced methyl 6-hydroxy-2-naphthoate whose hydrolysis led to the desired HNPA. An alternative route involves the oxidation of 6-acetyl-2-isopropylnaphthalene to 6-acetyl-2-naphthol on which subsequent oxidation and deacetylation gave HNPA. This method was Successfully extended to the synthesis of 4-hydroxybenzoic acid from p-cymene. (C) 2009 Elsevier Ltd, All rights reserved.