6-Methyl-dihydrosafrol | 4518-32-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并间二氧杂环戊烯类
• 英文名称: 6-Methyl-dihydrosafrol
• 英文别名: 5-methyl-6-propyl-benzo[1,3]dioxole；5-Methyl-6-propyl-1,3-benzodioxole
• CAS: 4518-32-5
• 化学式: C₁₁H₁₄O₂
• 分子量: 178.231
• InChiKey: OBFDDBXKSRKTMZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  13
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  18.5
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• 1,3-BENZODIOXOL COMPOUND AND USE OF SAME
  申请人：MATSUO Noritada

  公开号：US20070231413A1

  公开（公告）日：2007-10-04

  Containing the 1,3-benzodioxol compound represented by the formula (I): together with a pesticidal active ingredient in a pesticidal composition enhances a pest control effect of the pesticidal composition.

  将由化学式(I)代表的1,3-苯并二氧杂环己烷化合物与杀虫活性成分一起包含在杀虫组合物中，增强了杀虫组合物的杀虫效果。
• P-450-CATALYZED ENANTIOSELECTIVE CYCLOPROPANATION OF ELECTRON-DEFICIENT OLEFINS
  申请人：CALIFORNIA INSTITUTE OF TECHNOLOGY

  公开号：US20160032330A1

  公开（公告）日：2016-02-04

  The present invention pertains to the use of engineered variants of enzyme CYP102A, also known as P450-BM3, for cyclopropanation of olefins containing electron-withdrawing groups. One exemplary enzyme variant, referred to as BM3-HStar, contains five mutations away from wild-type P450-BM3, and demonstrates high activity towards cyclopropanation of olefinic substrates using ethyldiazoacetate (EDA) and other carbene transfer reagents. Products of these reactions are potential precursors of levomilnacipran derivatives, a class of compounds that have been shown to be selective inhibitors of monoamine transporters. In addition, cyclopropanation reactions with the P450-BM3 enzyme variants of the invention can be conducted in whole cells expressing the enzyme variants and can proceed under aerobic conditions.
• US3962415A
  申请人：——

  公开号：US3962415A

  公开（公告）日：1976-06-08
• US4058607A
  申请人：——

  公开号：US4058607A

  公开（公告）日：1977-11-15
• US7354911B2
  申请人：——

  公开号：US7354911B2

  公开（公告）日：2008-04-08