E-3-(heptadec-8'-enyl)benzene-1,2-diol | 122850-19-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: E-3-(heptadec-8'-enyl)benzene-1,2-diol
• 英文别名: 3-[(E)-heptadec-8-enyl]benzene-1,2-diol
• CAS: 122850-19-5
• 化学式: C₂₃H₃₈O₂
• 分子量: 346.554
• InChiKey: XOVWSFACOVXOLB-MDZDMXLPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.2
• 重原子数：
  25
• 可旋转键数：
  15
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  40.5
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  8-(2,2-dimethyl-1,3-benzodioxol-4-yl)octanal 、 nonyltriphenylphosphonium iodide 在 sodium hydride 、 溶剂黄146 作用下， 生成 3-<8'(Z)-heptadecenyl>catechol 、 E-3-(heptadec-8'-enyl)benzene-1,2-diol
  参考文献：
  名称：

  Sargent, Melvyn V.; Wangchareontrakul, Sirichai; Jefferson, Alan, Journal of the Chemical Society. Perkin transactions I, 1989, # 3, p. 431 - 439

  摘要：

  DOI：

文献信息

• PATCHES COMPRISING URUSHIOL, TEST PANELS COMPRISING THE SAME, AND METHODS OF USING THE SAME
  申请人：HAPTEN SCIENCES, INC.

  公开号：US20200405886A1

  公开（公告）日：2020-12-31

  Disclosed herein are urushiol-containing epicutaneous patches comprising a support material and a urushiol-containing film on a surface of the support material. A surface of the support material is coated with the urushiol-containing film. Also described herein are test panels comprising urushiol-containing epicutaneous patches of varying urushiol content. The test panels can be employed in methods to assess subject sensitivity to urushiol, to determine a dose-response relationship to varying doses of urushiol, and to assess efficacy of treatments to prevent or inhibit urushiol-induced contact dermatitis in a subject.