2,6,6-trimethylcyclohex-3-enol | 87887-17-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2,6,6-trimethylcyclohex-3-enol
• 英文别名: 2,2,6-Trimethyl-cyclohexen-(4)-ol；2,6,6-Trimethylcyclohex-3-en-1-ol
• CAS: 87887-17-0
• 化学式: C₉H₁₆O
• 分子量: 140.225
• InChiKey: MWWATNGLAQQABA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  10
• 可旋转键数：
  0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.78
• 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：

  2-丁烯酰氯 、 2,6,6-trimethylcyclohex-3-enol 在 甲基溴化镁 作用下， 以 四氢呋喃 为溶剂， 反应 1.0h， 以22%的产率得到(1S*,2S*)-2,6,6-trimethylcyclohex-3-en-1-yl (E)-but-2-enoate
  参考文献：
  名称：

  [EN] ORGANIC COMPOUND USED AS FRAGRANCE INGREDIENTS
  [FR] COMPOSÉ ORGANIQUE UTILISÉ COMME INGRÉDIENTS PARFUMÉS

  摘要：

  式I的化合物，其中R1、R2、R3和R4可以独立地选择为H或Me，n = 0、1，虚线表示单键，或在n = 0的情况下，在3'位有一个孤立的双键，或在n = 1的情况下，在3'或4'位有一个孤立的双键，波浪键表示相邻双键的未指定构型。所述化合物以及能够生成所述化合物的前体可用作香料成分。

  公开号：

  WO2017139920A1
• 作为产物：
  描述：

  2,2-二甲基-4-戊烯醛 在 Zhan catalyst-1B 、 magnesium 作用下， 以 四氢呋喃 、 甲苯 为溶剂， 反应 1.0h， 生成 2,6,6-trimethylcyclohex-3-enol
  参考文献：
  名称：

  [EN] ORGANIC COMPOUND USED AS FRAGRANCE INGREDIENTS
  [FR] COMPOSÉ ORGANIQUE UTILISÉ COMME INGRÉDIENTS PARFUMÉS

  摘要：

  式I的化合物，其中R1、R2、R3和R4可以独立地选择为H或Me，n = 0、1，虚线表示单键，或在n = 0的情况下，在3'位有一个孤立的双键，或在n = 1的情况下，在3'或4'位有一个孤立的双键，波浪键表示相邻双键的未指定构型。所述化合物以及能够生成所述化合物的前体可用作香料成分。

  公开号：

  WO2017139920A1

文献信息

• COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME
  申请人：Komatsuki Yasuhiro

  公开号：US20110081393A1

  公开（公告）日：2011-04-07

  Disclosed is a cooling sensation agent composition or sensory stimulation agent composition which contains at least one of diester compounds of dicarboxylic acid represented by the formula (1) wherein A represents CH 2 or CH═CH, n represents an integer of 0 to 4 when A is CH 2 , or 1 when A is CH═CH, B is an alcohol residue having 10 to 18 carbon atoms and containing a para-menthane skeleton, which may have a substituent, and C is an alcohol residue having 6 to 18 carbon atoms, which may have a substituent as well as a flavor or fragrance composition, a beverage, a food product, a perfume or cosmetic product, a toiletry product, daily utensil products or groceries, a fiber, a fiber product, clothes, clothing or a medicine, wherein the cooling sensation agent composition or the sensory stimulation agent composition is compounded.

  本文披露了一种包含以下化学式（1）所代表的二羧酸双酯化合物之一的冷却感剂组合物或感官刺激剂组合物，其中A代表CH2或CH═CH，n代表整数0至4（当A为CH2时）或1（当A为CH═CH时），B是含有10至18个碳原子并含有对蒎烷骨架的醇残基，可能有取代基，C是含有6至18个碳原子的醇残基，可能也有取代基，以及香料或香精组合物、饮料、食品产品、香水或化妆品产品、洗涤用品、日用品或杂货、纤维、纤维制品、衣服、服装或药品，其中复合了冷却感剂组合物或感官刺激剂组合物。
• Crotonates having use in perfumery
  申请人：GIVAUDAN SA

  公开号：US10343971B2

  公开（公告）日：2019-07-09

  A compound of formula I wherein R1, R2, R3 and R4 can be independently selected from H or Me, n=0, 1, the dotted lines are indicating single bonds, or in case n=0 an isolated double bond at position 3′, or in case n=1 an isolated double bond at position 3′ or 4′, and the wavy bond is indicating an unspecified configuration of the adjacent double bond. Said compounds, as well as precursors capable to generate said compounds, are useful as fragrance ingredients.

  式 I 的化合物 其中 R1、R2、R3 和 R4 可独立选自 H 或 Me、 n=0, 1, 虚线表示单键，或当 n=0 时，表示在 3′位置的孤立双键，或当 n=1 时，表示在 3′或 4′位置的孤立双键、 波浪键表示相邻双键的未定构型。上述化合物以及能够生成上述化合物的前体可用作香料成分。
• ORGANIC COMPOUNDS
  申请人：Givaudan SA

  公开号：EP3416943A1

  公开（公告）日：2018-12-26
• COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION
  申请人：Ishida Kenya

  公开号：US20110117147A1

  公开（公告）日：2011-05-19

  The invention relates to a cooling sensation agent composition with a prolonged cool sensation effect comprising at least one compound selected from Formula (1) wherein each of A and B is a hydrogen atom or a hydrocarbon group which may have one or more substituents, in which A and B are not hydrogen atoms simultaneously, and the total number of carbon atoms in A and B is in the range of 6 to 18; and Formulae (2) to (4) wherein R1, R2, and R3 each represent a residue of an alcohol selected from 1-menthol, 1-isopulegol, 3-(1-menthoxy)propan-1,2-diol, 2-(1-menthoxy)ethan-1-ol, 3-(1-menthoxy)propan-1-ol, 2-methyl-3-(1-menthoxy)propan-1,2-diol and para-menthan-3,8-diol), and R4 represents a residue of a branched or straight-chain, cyclic or linear, or saturated or unsaturated alcohol having 6 to 18 carbon atoms that may have one or more aromatic rings that may have a condensed ring and substituent groups such as hydroxyl and ether groups; and R6 represents a hydrocarbon group having 11 to 19 carbon atoms that may be branched and contain one or more unsaturated bonds. The invention also relates to a sensory stimulation agent composition comprising the cooling sensation agent composition; a flavor or fragrance composition, a beverage or food product, a perfume or cosmetic product, a toiletry product, a daily utensil product or grocery, a fiber, a fiber product, a cloth or a medicine comprising the cooling sensation agent composition or the sensory stimulation agent composition; a production method thereof; a cooling processing method of a fiber, fiber product or a cloth, comprising compounding the cooling sensation agent composition or the sensory stimulation agent composition; and new compounds.
• Organic Compounds
  申请人：GIVAUDAN SA

  公开号：US20190023643A1

  公开（公告）日：2019-01-24

  A compound of formula I wherein R 1 , R 2 , R 3 and R 4 can be independently selected from H or Me, n=0, 1, the dotted lines are indicating single bonds, or in case n=0 an isolated double bond at position 3′, or in case n=1 an isolated double bond at position 3′ or 4′, and the wavy bond is indicating an unspecified configuration of the adjacent double bond. Said compounds, as well as precursors capable to generate said compounds, are useful as fragrance ingredients.