Chlor-methyl-(4-methylpentyl)-vinylsilan

• 分子结构分类: 有机化合物 - 有机金属化合物 - 有机类金属化合物
• 英文名称: Chlor-methyl-(4-methylpentyl)-vinylsilan
• 化学式: C₉H₁₉ClSi
• 分子量: 190.788
• InChiKey: BUWBFMVPXVLZJY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.96
• 重原子数：
  11.0
• 可旋转键数：
  5.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  0.0
• 氢给体数：
  0.0
• 氢受体数：
  0.0

反应信息

• 作为反应物：
  描述：

  Chlor-methyl-(4-methylpentyl)-vinylsilan 在 sodium hydroxide 作用下， 以 乙醚 、 水 为溶剂， 反应 0.5h， 以84%的产率得到Dihydrosilalinalool
  参考文献：
  名称：

  Sila-Riechstoffe und Riechstoff-Isostere, 13. Mitt.Grimmsche Hydridisostere im Bereich der Duftstoffklasse des Linalools

  摘要：

  Substitution of the (CH3)(3)CH=CH group by (CH3)(2)C=N in linalool as well as by the (CPT3)(2)CH-CH2 group in linalool and in sila-linalool does not lead to noticeable changes of their scent qualities. On the contrary, substitution of the OH group at the tertiary C atom by NH2 or CH3 - hydride isosteric to OH according to Grimm - affords fishy or etheric instead of the original flowery smells thus indicating a transition to different basic classes of odor. Similar results were obtained with the linalool-like scents of benzyldimethylcarbinol and phenylethyldimethylcarbinol. Therefore the theory of Amoore, after which only shape and size of molecules are ruling their odor qualities, must be called in question.

  DOI：

  10.1007/bf00813801
• 作为产物：
  描述：

  甲基乙烯基二氯硅烷 、 1-溴-4-甲基戊烷 在 magnesium 作用下， 生成 Chlor-methyl-(4-methylpentyl)-vinylsilan
  参考文献：
  名称：

  Sila-Riechstoffe und Riechstoff-Isostere, 13. Mitt.Grimmsche Hydridisostere im Bereich der Duftstoffklasse des Linalools

  摘要：

  Substitution of the (CH3)(3)CH=CH group by (CH3)(2)C=N in linalool as well as by the (CPT3)(2)CH-CH2 group in linalool and in sila-linalool does not lead to noticeable changes of their scent qualities. On the contrary, substitution of the OH group at the tertiary C atom by NH2 or CH3 - hydride isosteric to OH according to Grimm - affords fishy or etheric instead of the original flowery smells thus indicating a transition to different basic classes of odor. Similar results were obtained with the linalool-like scents of benzyldimethylcarbinol and phenylethyldimethylcarbinol. Therefore the theory of Amoore, after which only shape and size of molecules are ruling their odor qualities, must be called in question.

  DOI：

  10.1007/bf00813801

文献信息

• Sila-Riechstoffe und Riechstoff-Isostere, 13. Mitt.Grimmsche Hydridisostere im Bereich der Duftstoffklasse des Linalools
  作者：U. Wannagat、V. Damrath、U. Harder

  DOI：10.1007/bf00813801

  日期：1994.11

  Substitution of the (CH3)(3)CH=CH group by (CH3)(2)C=N in linalool as well as by the (CPT3)(2)CH-CH2 group in linalool and in sila-linalool does not lead to noticeable changes of their scent qualities. On the contrary, substitution of the OH group at the tertiary C atom by NH2 or CH3 - hydride isosteric to OH according to Grimm - affords fishy or etheric instead of the original flowery smells thus indicating a transition to different basic classes of odor. Similar results were obtained with the linalool-like scents of benzyldimethylcarbinol and phenylethyldimethylcarbinol. Therefore the theory of Amoore, after which only shape and size of molecules are ruling their odor qualities, must be called in question.