2,6,6-三甲基-2-环己烯-1-醇 | 54345-59-4

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 2,6,6-三甲基-2-环己烯-1-醇
• 英文名称: 2,6,6-Trimethyl-2-cyclohexen-1-ol
• 英文别名: 2,6,6-trimethylcyclohex-2-en-1-ol
• CAS: 54345-59-4
• 化学式: C₉H₁₆O
• 分子量: 140.225
• InChiKey: QOIDDSNHBKJZNV-UHFFFAOYSA-N

物化性质

• 沸点：
  80-85 °C(Press: 12 Torr)
• 密度：
  0.915±0.06 g/cm3(Predicted)
• 保留指数：
  1205

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 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

安全信息

• 海关编码：
  2906199090

反应信息

• 作为反应物：
  描述：

  2,6,6-三甲基-2-环己烯-1-醇 在 palladium on activated charcoal 氢气 、 sodium hydride 作用下， 反应 32.0h， 生成 1-(cis-2,2,6-Trimethylcyclohexyloxy)-2-pentanol
  参考文献：
  名称：

  埃努涅雷伊河上的古鲁茨瓦赫尔尼翁冯·阿克勒肖恩的非对等†

  摘要：

  离子酮系列中对醇的非对映选择性气味感知

  DOI：

  10.1002/hlca.19850680722
• 作为产物：
  描述：

  乙酸-(2,6,6-三甲基-环己-2-烯基酯) 在 lithium aluminium tetrahydride 作用下， 以 乙醚 为溶剂， 生成 2,6,6-三甲基-2-环己烯-1-醇
  参考文献：
  名称：

  氧化烯丙基四氢呋喃和乙二醛乙酸酯†

  摘要：

  烯丙基醇的四乙酸铅（LTA）氧化1，10，14和19通到环氧化物的形成2，11，15和20，中的缺电子醇氧的一种新颖的内部加成反应的烯丙基双键的产品。在一些情况下（10，14）的新型乙酰氧基化烯醇醚的形成（12，16）中观察到。烯丙基二烯醇21和29的LTA氧化引起环氧乙酸酯25和33的形成，环氧乙酸酯25和33是类似的内部加成反应的产物。此外，各种环化产品（已经分离出22、23、24、26、30、31、32和34），其形成需要将烯丙基反式双键异构化为顺式。

  DOI：

  10.1002/hlca.19740570418

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。
• Uzarewicz; Dresler, Polish Journal of Chemistry, 1997, vol. 71, # 2, p. 181 - 195
  作者：Uzarewicz、Dresler

  DOI：——

  日期：——
• Weyerstahl, Peter; Buchmann, Bernd; Marschall-Weyerstahl, Helga, Liebigs Annalen der Chemie, 1988, p. 507 - 524
  作者：Weyerstahl, Peter、Buchmann, Bernd、Marschall-Weyerstahl, Helga

  DOI：——

  日期：——
• WEVERSTAHL, PETER;BUCHMANN, BERND;MARSCHALL-WEYERSTAHL, HELGA, LIEBIGS ANN. CHEM.,(1988) N 6, 507-523
  作者：WEVERSTAHL, PETER、BUCHMANN, BERND、MARSCHALL-WEYERSTAHL, HELGA

  DOI：——

  日期：——
• 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.