3-Methyl-5-(2,2,4-trimethylcyclopent-3-en-1-yl)pent-3-en-2-ol

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 3-Methyl-5-(2,2,4-trimethylcyclopent-3-en-1-yl)pent-3-en-2-ol
• 英文别名: (E)-3-methyl-5-(2,2,4-trimethylcyclopent-3-en-1-yl)pent-3-en-2-ol
• 化学式: C₁₄H₂₄O
• 分子量: 208.344
• InChiKey: TUURAKACLVCIJJ-IZZDOVSWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  3-Methyl-5-(2,2,4-trimethylcyclopent-3-en-1-yl)pent-3-en-2-ol 在 platinum(IV) oxide 氢气 作用下， 以 甲醇 为溶剂， 生成 3-Methyl-5-(2,2,4-trimethylcyclopent-3-en-1-yl)pentan-2-ol
  参考文献：
  名称：

  Riechstoffsynthesen mit Fencholenaldehyd

  摘要：

  DOI：

  10.1007/bf00810841
• 作为产物：
  描述：

  (2,2,4-三甲基-3-环戊烯-1-基)乙醛 在 lithium aluminium tetrahydride 作用下， 以 乙醚 为溶剂， 反应 2.0h， 生成 3-Methyl-5-(2,2,4-trimethylcyclopent-3-en-1-yl)pent-3-en-2-ol
  参考文献：
  名称：

  Riechstoffsynthesen mit Fencholenaldehyd

  摘要：

  DOI：

  10.1007/bf00810841

文献信息

• SCHULZE, KLAUS;UHLIG, HOLGER, MONATSH. CHEM., 120,(1989) N-7, C. 547-559
  作者：SCHULZE, KLAUS、UHLIG, HOLGER

  DOI：——

  日期：——
• NOVEL AROMA CHEMICALS HAVING A 1,2,2-TRIMETHYLCYCLOPENTAN-1-YL MOIETY
  申请人：BASF SE

  公开号：US20180171262A1

  公开（公告）日：2018-06-21

  The present invention relates to novel compounds of general formulae (la), (lb) and (Ic) and to the stereoisomers thereof. The compounds are useful as a fragrance or as flavor as they have a sandalwood like scent. The invention also relates to a method for imparting or modifying a scent or a flavor to a composition by including said compounds into such composition, to a fragrance containing composition and/or a fragrance material containing said compound and to a process for preparing these compounds. X is C(R 4 )—OH or C═O; R 1 is selected from the group consisting of hydrogen, C 1 -C 4 -alkyl, C 2 -C 4 -alkenyl and C 3 -C 4 -cycloalkyl, R 2 is selected from the group consisting of hydrogen, C 1 -C 4 -alkyl, C 2 -C 4 -alkenyl and C 3 -C 4 -cycloalkyl, R 3 is C 1 -C 4 -alkyl, R 3a is selected from the group consisting of hydrogen and C 1 -C 4 -alkyl, R 3b is hydrogen or together with R 3a is CH 2 ; R 4 is selected from the group consisting of hydrogen and C 1 -C 4 -alkyl.
• Riechstoffsynthesen mit Fencholenaldehyd
  作者：Klaus Schulze、Holger Uhlig

  DOI：10.1007/bf00810841

  日期：——