4-methyl-1-methylsulfanyl-pentan-2-one | 39195-73-8

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 4-methyl-1-methylsulfanyl-pentan-2-one
• 英文别名: 4-Methyl-1-methylsulfanylpentan-2-one
• CAS: 39195-73-8
• 化学式: C₇H₁₄OS
• 分子量: 146.254
• InChiKey: KRKNGWHUCVJAHT-UHFFFAOYSA-N

物化性质

• 沸点：
  79.8-80 °C(Press: 12.5 Torr)
• 密度：
  0.940±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  9
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  42.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  1-chloro-4-methylpentan-2-one 在 sodium hydroxide 、 硫化氢 作用下， 生成 4-methyl-1-methylsulfanyl-pentan-2-one
  参考文献：
  名称：

  Asinger,F. et al., Justus Liebigs Annalen der Chemie, 1964, vol. 672, p. 156 - 178

  摘要：

  DOI：

文献信息

• Olfactory signature and odorant mixture having the same
  申请人：Yeda Research and Development Co. Ltd.

  公开号：US11062794B2

  公开（公告）日：2021-07-13

  An odorant mixture is disclosed. The odorant mixture comprises N odorant components wherein N equals at least 20. Each odorant component is characterized by a multidimensional vector of attributes. A z score of an average of characteristic distances between vectors corresponding to odorant components in the mixture and vectors corresponding to odorant components in a group of M odorant components but not in the mixture is less than 2.

  本发明公开了一种气味剂混合物。气味剂混合物包括 N 种气味剂成分，其中 N 至少等于 20。每个气味成分由一个多维属性向量表征。混合物中的气味成分对应向量与 M 组气味成分中但不在混合物中的气味成分对应向量之间的平均特征距离的 Z 值小于 2。
• OLFACTORY SIGNATURE AND ODORANT MIXTURE HAVING THE SAME
  申请人：Yeda Research and Development Co. Ltd.

  公开号：US20140221269A1

  公开（公告）日：2014-08-07

  An odorant mixture is disclosed. The odorant mixture comprises N odorant components wherein N equals at least 20. Each odorant component is characterized by a multidimensional vector of attributes. A z score of an average of characteristic distances between vectors corresponding to odorant components in the mixture and vectors corresponding to odorant components in a group of M odorant components but not in the mixture is less than 2.
• US9959392B2
  申请人：——

  公开号：US9959392B2

  公开（公告）日：2018-05-01
• [EN] OLFACTORY SIGNATURE AND ODORANT MIXTURE HAVING THE SAME<br/>[FR] SIGNATURE OLFACTIVE ET MÉLANGE ODORANT LA CONTENANT
  申请人：YEDA RES & DEV

  公开号：WO2013035070A1

  公开（公告）日：2013-03-14

  An odorant mixture is disclosed. The odorant mixture comprises N odorant components wherein N equals at least 20. Each odorant component is characterized by a multidimensional vector of attributes. A z score of an average of characteristic distances between vectors corresponding to odorant components in the mixture and vectors corresponding to odorant components in a group of M odorant components but not in the mixture is less than 2.
• Asinger,F. et al., Justus Liebigs Annalen der Chemie, 1964, vol. 672, p. 156 - 178
  作者：Asinger,F. et al.

  DOI：——

  日期：——