2-tert-butylsulfanyl-1-(4-methoxyphenyl)ethanone | 628298-05-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-tert-butylsulfanyl-1-(4-methoxyphenyl)ethanone
• CAS: 628298-05-5
• 化学式: C₁₃H₁₈O₂S
• mdl: MFCD12145872
• 分子量: 238.351
• InChiKey: DRDIPSQGTRZIGF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  16
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.461
• 拓扑面积：
  51.6
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-tert-butylsulfanyl-1-(4-methoxyphenyl)ethanone 在 sodium tetrahydroborate 作用下， 以 甲醇 为溶剂， 以92%的产率得到2-tert-butylsulfanyl-1-(4-methoxyphenyl)ethanol
  参考文献：
  名称：

  Derivatized Amino Acids Relevant to Native Peptide Synthesis by Chemical Ligation and Acyl Transfer

  摘要：

  Three amino acids were converted into the derivatives 5.2 (from glycine), 6.4a and 6.4b (from alanine), and 8.3a and 8.3b (from O-benzyl serine). These N-alkylated amino acids, which can be deprotected after conversion of the carboxyl into an amide, correspond to the general structure 2.1, a compound class of use in the study of peptide segment coupling by the ligation-acyl transfer method.

  DOI：

  10.1021/jo030192r
• 作为产物：
  描述：

  叔丁基硫醇 、 alpha-溴-4-甲氧基苯乙酮 在 正丁基锂 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 反应 2.5h， 以98%的产率得到2-tert-butylsulfanyl-1-(4-methoxyphenyl)ethanone
  参考文献：
  名称：

  Derivatized Amino Acids Relevant to Native Peptide Synthesis by Chemical Ligation and Acyl Transfer

  摘要：

  Three amino acids were converted into the derivatives 5.2 (from glycine), 6.4a and 6.4b (from alanine), and 8.3a and 8.3b (from O-benzyl serine). These N-alkylated amino acids, which can be deprotected after conversion of the carboxyl into an amide, correspond to the general structure 2.1, a compound class of use in the study of peptide segment coupling by the ligation-acyl transfer method.

  DOI：

  10.1021/jo030192r

文献信息

• Derivatized Amino Acids Relevant to Native Peptide Synthesis by Chemical Ligation and Acyl Transfer
  作者：Derrick L. J. Clive、Soleiman Hisaindee、Don M. Coltart

  DOI：10.1021/jo030192r

  日期：2003.11.1

  Three amino acids were converted into the derivatives 5.2 (from glycine), 6.4a and 6.4b (from alanine), and 8.3a and 8.3b (from O-benzyl serine). These N-alkylated amino acids, which can be deprotected after conversion of the carboxyl into an amide, correspond to the general structure 2.1, a compound class of use in the study of peptide segment coupling by the ligation-acyl transfer method.

表征谱图