2-(10-thioxo-10H-9-oxa-10λ5-phosphaphenanthren-10-yl)benzene-1,4-diol | 1312947-02-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 2-(10-thioxo-10H-9-oxa-10λ5-phosphaphenanthren-10-yl)benzene-1,4-diol
• 英文别名: 6-(2,5-dihydroxyphenyl)-6H-dibenzo[c,e][1,2]oxaphosphinine 6-sulfide；2-(6-Sulfidobenzo[c][2,1]benzoxaphosphinin-6-ium-6-yl)benzene-1,4-diol；2-(6-sulfidobenzo[c][2,1]benzoxaphosphinin-6-ium-6-yl)benzene-1,4-diol
• CAS: 1312947-02-6
• 化学式: C₁₈H₁₃O₃PS
• 分子量: 340.339
• InChiKey: QWRBZZBDGAWHON-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  23
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  54.6
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  10-氯-9,10-二氢-9-氧杂-10-磷杂菲 在 tetraphosphorus decasulfide 、 水 作用下， 以 甲苯 为溶剂， 反应 20.5h， 生成 2-(10-thioxo-10H-9-oxa-10λ5-phosphaphenanthren-10-yl)benzene-1,4-diol
  参考文献：
  名称：

  新型硫代磷环分子6H-二苯并[c,e][1,2]氧代膦6-硫化物的合成及反应性

  摘要：

  The new 6H-dibenzo[c,e][1,2]oxaphosphinine 6-sulfide (1) was synthesized and characterized by H-1-, C-13-, P-31-NMR, IR spectroscopy as well as X-ray diffraction and HR-MS. The reactivity of (1) was investigated with a series of test reactions, including Michael-type additions and the Atherton-Todd-reaction and finally compared to that of the parent 9,10-dihydro-9-oxa-10-phosphaphenanthrene-10-oxide.

  DOI：

  10.3987/com-10-12124

文献信息

• Synthesis and Reactivity of 6H-Dibenzo[c,e][1,2]oxaphosphinine 6-Sulfide, a Novel Thiophosphacyclic Molecule
  作者：Manfred Döring、Sebastian Wagner、Thomas Zevaco、Michael Ciesielski、Olaf Walter、Muriel Rakotomalala

  DOI：10.3987/com-10-12124

  日期：——

  The new 6H-dibenzo[c,e][1,2]oxaphosphinine 6-sulfide (1) was synthesized and characterized by H-1-, C-13-, P-31-NMR, IR spectroscopy as well as X-ray diffraction and HR-MS. The reactivity of (1) was investigated with a series of test reactions, including Michael-type additions and the Atherton-Todd-reaction and finally compared to that of the parent 9,10-dihydro-9-oxa-10-phosphaphenanthrene-10-oxide.