5-Dimethylamino-naphthalene-1-sulfonic acid 3-phenyl-propyl ester | 601488-42-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 5-Dimethylamino-naphthalene-1-sulfonic acid 3-phenyl-propyl ester
• 英文别名: 3-Phenylpropyl 5-(dimethylamino)naphthalene-1-sulfonate；3-phenylpropyl 5-(dimethylamino)naphthalene-1-sulfonate
• CAS: 601488-42-0
• 化学式: C₂₁H₂₃NO₃S
• 分子量: 369.485
• InChiKey: NEXQEMLDPZGVEJ-UHFFFAOYSA-N

物化性质

• 沸点：
  532.1±38.0 °C(Predicted)
• 密度：
  1.217±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  26
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  55
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  5-Dimethylamino-naphthalene-1-sulfonic acid 3-phenyl-propyl ester 在 锂硼氢 作用下， 以 四氢呋喃 为溶剂， 反应 16.0h， 以83%的产率得到正丙基苯
  参考文献：
  名称：

  A real time reaction monitoring using fluorescent dansyl group as a solid-phase leaving group

  摘要：

  A real time monitoring method to monitor the progress of the solid-phase reaction has been developed. The substitution reaction on the solid-phase was clearly monitored as a change in the color depth using the fluorescent dansyl group as the leaving group. This methodology is applicable to both parallel and split combinatorial synthesis. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(03)01406-0
• 作为产物：
  描述：

  3-苯丙醇 、 丹酰氯 在 吡啶 作用下， 以 二氯甲烷 为溶剂， 反应 7.0h， 以81%的产率得到5-Dimethylamino-naphthalene-1-sulfonic acid 3-phenyl-propyl ester
  参考文献：
  名称：

  A real time reaction monitoring using fluorescent dansyl group as a solid-phase leaving group

  摘要：

  A real time monitoring method to monitor the progress of the solid-phase reaction has been developed. The substitution reaction on the solid-phase was clearly monitored as a change in the color depth using the fluorescent dansyl group as the leaving group. This methodology is applicable to both parallel and split combinatorial synthesis. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(03)01406-0