2,6-Dimethyl-6-methylsulfanylmethyl-4-phenylsulfanylmethyl-cyclohexa-2,4-dienone | 294850-78-5

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 2,6-Dimethyl-6-methylsulfanylmethyl-4-phenylsulfanylmethyl-cyclohexa-2,4-dienone
• 英文别名: 2,6-Dimethyl-6-(methylsulfanylmethyl)-4-(phenylsulfanylmethyl)cyclohexa-2,4-dien-1-one；2,6-dimethyl-6-(methylsulfanylmethyl)-4-(phenylsulfanylmethyl)cyclohexa-2,4-dien-1-one
• CAS: 294850-78-5
• 化学式: C₁₇H₂₀OS₂
• 分子量: 304.477
• InChiKey: JXHWUJCNLWWFIA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  20
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  67.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2,6-Dimethyl-6-methylsulfanylmethyl-4-phenylsulfanylmethyl-cyclohexa-2,4-dienone 在 间氯过氧苯甲酸 作用下， 以 二氯甲烷 为溶剂， 以93.7%的产率得到4-(Benzenesulfonylmethyl)-2,6-dimethyl-6-(methylsulfonylmethyl)cyclohexa-2,4-dien-1-one
  参考文献：
  名称：

  Synthesis of thiophenyl substituted cyclohexa-2,4-dien-1-one and its photocleavage coupling reaction with amines

  摘要：

  Thiophenyl substituted cyclohexa-2,4-dien-1-ones were synthesized and photolyzed in the presence of various amines to afford the amides containing diene moeties via the ketene intermediate under visible light irradiation at 38 degrees C. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(00)00291-2
• 作为产物：
  描述：

  4-(氯甲基)-2,6-二甲基苯酚 在 氢氧化钾 、 N-氯代丁二酰亚胺 、 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成 2,6-Dimethyl-6-methylsulfanylmethyl-4-phenylsulfanylmethyl-cyclohexa-2,4-dienone
  参考文献：
  名称：

  Synthesis of thiophenyl substituted cyclohexa-2,4-dien-1-one and its photocleavage coupling reaction with amines

  摘要：

  Thiophenyl substituted cyclohexa-2,4-dien-1-ones were synthesized and photolyzed in the presence of various amines to afford the amides containing diene moeties via the ketene intermediate under visible light irradiation at 38 degrees C. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(00)00291-2

文献信息

• Synthesis of thiophenyl substituted cyclohexa-2,4-dien-1-one and its photocleavage coupling reaction with amines
  作者：Tae Woo Kwon、Young Mee Kim、Suk Jin Song、Yong Uk Kwon、Sung Kee Chung

  DOI：10.1016/s0960-894x(00)00291-2

  日期：2000.7

  Thiophenyl substituted cyclohexa-2,4-dien-1-ones were synthesized and photolyzed in the presence of various amines to afford the amides containing diene moeties via the ketene intermediate under visible light irradiation at 38 degrees C. (C) 2000 Elsevier Science Ltd. All rights reserved.