methyl (1S,4R,5S)-4-[(4-chlorophenyl)methyl]-1-methyl-6-oxabicyclo[3.2.0]heptane-5-carboxylate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 氧杂环己烷
• 英文名称: methyl (1S,4R,5S)-4-[(4-chlorophenyl)methyl]-1-methyl-6-oxabicyclo[3.2.0]heptane-5-carboxylate
• 化学式: C₁₆H₁₉ClO₃
• 分子量: 294.77
• InChiKey: HYBMBYYLQSUYLN-UHOFOFEASA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  20
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

文献信息

• METHOD FOR MANUFACTURING OXETANE COMPOUND, METHOD FOR MANUFACTURING AZOLYLMETHYLCYCLOPENTANOL COMPOUND, AND INTERMEDIATE COMPOUND
  申请人：Sunagawa Kazuhiko

  公开号：US20140128611A1

  公开（公告）日：2014-05-08

  In order to produce an intermediate from which a cyclic alcohol compound can be stereoselectively obtained, a method for producing an oxetane compound according to the present invention includes the step of reacting, with a cyanide salt, a compound represented by Formula (I): wherein R 1 is selected from a hydrogen atom and an alkyl group optionally having a substituent; X 1 is selected from a halogen atom and —OSO 2 R 3 where R 3 is selected from an alkyl group optionally having a substituent, a phenyl group, and a naphthyl group; and a ring Z1 represents a cyclic hydrocarbon optionally having a substituent, to obtain a compound represented by Formula (II):

  为了制备一种中间体，从中可以立体选择性地获得环状醇化合物，根据本发明的一种制备氧杂环化合物的方法包括以下步骤：与氰盐反应，化合物的化学式为（I）：其中R1选自氢原子和一个具有取代基的烷基基团；X1选自卤原子和—OSO2R3，其中R3选自具有取代基的烷基基团，苯基和萘基；环Z1表示一个具有取代基的环烃，以获得化合物的化学式为（II）。
• US9278966B2
  申请人：——

  公开号：US9278966B2

  公开（公告）日：2016-03-08