6-(1-Hydroxybutyl)-2,5-dimethoxy-7-prop-1-ynylnaphthalene-1,4-dione | 931430-58-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 6-(1-Hydroxybutyl)-2,5-dimethoxy-7-prop-1-ynylnaphthalene-1,4-dione
• CAS: 931430-58-9
• 化学式: C₁₉H₂₀O₅
• 分子量: 328.365
• InChiKey: BMBBEUMGUKDGSA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  24
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  72.8
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  6-(1-Hydroxybutyl)-2,5-dimethoxy-7-prop-1-ynylnaphthalene-1,4-dione 在 2,6-二甲基吡啶 、 N-氯代丁二酰亚胺 作用下， 以 二氯甲烷 为溶剂， 生成 2-chloro-3,3,8-trimethoxy-6-prop-1-ynyl-7-[1-tri(propan-2-yl)silyloxybutyl]-2H-naphthalene-1,4-dione
  参考文献：
  名称：

  Synthesis of chloroquinocin, a pyranonaphthoquinone antibiotic against Gram-positive bacteria

  摘要：

  Chloroquinocin 1 is an antimicrobial agent against Gram-positive bacteria, including MRSA (methicillin-resistant Staphylococcus aureus). A successful synthesis of 1 was attained through a unique chlorination of the corresponding naphthoquinone derivative 12 as a key step. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2007.01.020
• 作为产物：
  描述：

  1-(1,5,6-Trimethoxy-8-phenylmethoxy-3-prop-1-ynylnaphthalen-2-yl)butan-1-ol 在 水 、 2,3-二氯-5,6-二氰基-1,4-苯醌 作用下， 以 1,4-二氧六环 为溶剂， 以71%的产率得到6-(1-Hydroxybutyl)-2,5-dimethoxy-7-prop-1-ynylnaphthalene-1,4-dione
  参考文献：
  名称：

  Synthesis of chloroquinocin, a pyranonaphthoquinone antibiotic against Gram-positive bacteria

  摘要：

  Chloroquinocin 1 is an antimicrobial agent against Gram-positive bacteria, including MRSA (methicillin-resistant Staphylococcus aureus). A successful synthesis of 1 was attained through a unique chlorination of the corresponding naphthoquinone derivative 12 as a key step. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2007.01.020

文献信息

• Synthesis of chloroquinocin, a pyranonaphthoquinone antibiotic against Gram-positive bacteria
  作者：Akiko Shimbashi、Shigeru Nishiyama

  DOI：10.1016/j.tetlet.2007.01.020

  日期：2007.2

  Chloroquinocin 1 is an antimicrobial agent against Gram-positive bacteria, including MRSA (methicillin-resistant Staphylococcus aureus). A successful synthesis of 1 was attained through a unique chlorination of the corresponding naphthoquinone derivative 12 as a key step. (c) 2007 Elsevier Ltd. All rights reserved.