6-methylheptanoic acid p-bromophenacyl ester | 62337-59-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 6-methylheptanoic acid p-bromophenacyl ester
• 英文别名: 2-(4-Bromophenyl)-2-oxoethyl 6-methylheptanoate；[2-(4-bromophenyl)-2-oxoethyl] 6-methylheptanoate
• CAS: 62337-59-1
• 化学式: C₁₆H₂₁BrO₃
• 分子量: 341.245
• InChiKey: CCDRMYNRCJTNGJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  20
• 可旋转键数：
  9
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  43.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2,4'-二溴苯乙酮 、 在 氢氧化钾 、 三乙胺 作用下， 以 甲醇 、 丙酮 为溶剂， 反应 1.25h， 生成 对溴苯甲酰甲基苯甲酸酯 、 6-methylheptanoic acid p-bromophenacyl ester
  参考文献：
  名称：

  Two acyl sucroses from Petunia nyctaginiflora

  摘要：

  Two new acyl sucroses were isolated from the epigeal parts of Petunia nyctagin flora Juss. (Solanaceae). Their structures were determined to be 2, 3, 4-tri (5-methylhexanoyl)-alpha-D-glucopyranosyl-beta-D-fructofuranoside (2) and 2, 3, 4-tri (6-methylheptanoyl)-alpha-D-glucopyranosyl-beta-D-fructofuranoside (4) on the basis of chemical and spectroscopic evidence. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0031-9422(03)00162-6

文献信息

• Two acyl sucroses from Petunia nyctaginiflora
  作者：Ajay Pratap Singh、Ajit Kumar Singh、A.Sajeli Begum、Mahendra Sahai

  DOI：10.1016/s0031-9422(03)00162-6

  日期：2003.6

  Two new acyl sucroses were isolated from the epigeal parts of Petunia nyctagin flora Juss. (Solanaceae). Their structures were determined to be 2, 3, 4-tri (5-methylhexanoyl)-alpha-D-glucopyranosyl-beta-D-fructofuranoside (2) and 2, 3, 4-tri (6-methylheptanoyl)-alpha-D-glucopyranosyl-beta-D-fructofuranoside (4) on the basis of chemical and spectroscopic evidence. (C) 2003 Elsevier Science Ltd. All rights reserved.