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2,4-二甲基-1-辛醇 | 249745-60-6

中文名称
2,4-二甲基-1-辛醇
中文别名
——
英文名称
2,4-dimethyloctan-1-ol
英文别名
Octanol, 2,4-dimethyl-
2,4-二甲基-1-辛醇化学式
CAS
249745-60-6
化学式
C10H22O
mdl
——
分子量
158.284
InChiKey
DGPIFVIIBUMGDJ-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

物化性质

  • 沸点:
    206.4±8.0 °C(Predicted)
  • 密度:
    0.824±0.06 g/cm3(Predicted)

计算性质

  • 辛醇/水分配系数(LogP):
    3.6
  • 重原子数:
    11
  • 可旋转键数:
    6
  • 环数:
    0.0
  • sp3杂化的碳原子比例:
    1.0
  • 拓扑面积:
    20.2
  • 氢给体数:
    1
  • 氢受体数:
    1

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量
  • 下游产品
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    2,4-二甲基-1-辛醇三苯基膦 作用下, 以 二氯甲烷 为溶剂, 生成 1-bromo-2,4-dimethyloctane
    参考文献:
    名称:
    松树蝇类雌性信息素前体和一些结构相关的甲基支链长链2-烷醇的合成。
    摘要:
    以适度的产率合成了3,7-二甲基-2-十一烷醇,3,7,9-三甲基-2-十三烷醇和3,7,11-三甲基-2-十三烷醇。所述醇分别是松木锯蝇物种Diprion nipponica,Macropirprion nemoralis和Microdiprion pallipes雌性信息素的前体。3,8,12-三甲基-2-十三烷醇,赤型-(2R,3R,11R / S)-3,11-二甲基-2-十四烷醇,3,5-二甲基-2-十四烷醇和5的立体异构体混合物,还以中等收率合成了7-二甲基-2-十四烷醇,该结构与松锯齿物种的性信息素醇前体有关。合成中的关键反应是通过使用不同的烷基锂作为亲核试剂,γ-丁内酯的开环。
    DOI:
    10.1023/a:1016289902732
  • 作为产物:
    描述:
    n-Butyl-methyl-malonsaeure氢氧化钾 、 lithium aluminium tetrahydride 、 sodium三苯基膦 作用下, 以 乙醚乙醇二氯甲烷 为溶剂, 生成 2,4-二甲基-1-辛醇
    参考文献:
    名称:
    松树蝇类雌性信息素前体和一些结构相关的甲基支链长链2-烷醇的合成。
    摘要:
    以适度的产率合成了3,7-二甲基-2-十一烷醇,3,7,9-三甲基-2-十三烷醇和3,7,11-三甲基-2-十三烷醇。所述醇分别是松木锯蝇物种Diprion nipponica,Macropirprion nemoralis和Microdiprion pallipes雌性信息素的前体。3,8,12-三甲基-2-十三烷醇,赤型-(2R,3R,11R / S)-3,11-二甲基-2-十四烷醇,3,5-二甲基-2-十四烷醇和5的立体异构体混合物,还以中等收率合成了7-二甲基-2-十四烷醇,该结构与松锯齿物种的性信息素醇前体有关。合成中的关键反应是通过使用不同的烷基锂作为亲核试剂,γ-丁内酯的开环。
    DOI:
    10.1023/a:1016289902732
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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。
  • Method for forming multilayer coating film
    申请人:NIPPON PAINT AUTOMOTIVE COATINGS CO., LTD.
    公开号:US10773276B2
    公开(公告)日:2020-09-15
    The coating film formed on an automobile body has softness during a film formation even on a thermally expandable/shrinkable base, and the cured film has an excellent appearance. Provided is a method for forming a multilayer coating film, the method comprises: applying an aqueous intermediate coating composition and preheating the applied composition at 60 to 90° C. to form an uncured film; preheating to form an uncured base coating film and a clear coating film; and baking and curing these uncured films to form a multilayer coating film, wherein the aqueous intermediate coating composition comprises (a) an acrylic resin emulsion having a specific properties, and (b) a film formation auxiliary agent that is a fatty acid diester compound having a boiling point of 280° C. to 350° C., and a cured film comprising (a) and (b) at a mass ratio of 3:1 has a rupture elongation of 1% or more.
    在汽车车身上形成的涂膜在成膜过程中即使在热胀冷缩基底上也具有柔软性,固化后的涂膜具有极佳的外观。 本发明提供了一种形成多层涂膜的方法,该方法包括:涂敷水性中间涂层组合物,并在 60 至 90°C 的温度下预热所涂敷的组合物以形成未固化的涂膜; 预热以形成未固化的基底涂膜和透明涂膜;以及 烘烤并固化这些未固化膜,形成多层涂膜、 其中,水性中间涂层组合物包括:(a) 具有特定性能的丙烯酸树脂乳液;(b) 成膜助剂,它是一种脂肪酸二酯化合物,沸点在 280 摄氏度至 350 摄氏度之间;以及 由质量比为 3:1 的(a)和(b)组成的固化薄膜的断裂伸长率为 1%或以上。
  • Making Mixtures to Solve Structures: Structural Elucidation via Combinatorial Synthesis
    作者:Nigel A. Lengkeek、Paul F. Greenwood、Blake Nguyen、George A. Koutsantonis、Matthew J. Piggott
    DOI:10.1021/cc900134t
    日期:2010.1.11
    A domino Horner-Wadsworth-Emmons olefination strategy has been used to prepare homologous series of (polyen)ones, and through combinatorial elaboration, corresponding families of highly branched hydrocarbons. Gas chromatography-mass spectrometry of the mixtures has enabled the rapid and unambiguous identification of several highly branched alkanes of geochemical importance. This is the first example of the use of combinatorial synthesis for the elucidation of structural connectivity.
  • Sex Pheromone of the Pine Sawfly, Macrodiprion nemoralis. Stereoselective Synthesis of the Sixteen Stereoisomers of 3,7,9-Trimethyl-2-tridecyl Acetate.
    作者:Staffan Karlsson、Erik Hedenström、Luis Lezama、María I. Arriortua、Margareta Björkman、Benita H. Forngren、Tobias Forngren、Per Hartvig、Karin Markides、Ulrika Yngve、Mattias Ögren
    DOI:10.3891/acta.chem.scand.53-0620
    日期:——
    The sixteen stereoisomers of 3,7,9-trimethyl-2-tridecyl acetate (5Ac) were prepared individually, each in over 99.5% stereochemical purity. The syntheses were based on the ring opening of a pure enantiomer of cis-3,4-dimethyl-gamma-butyrolactone using a pure stereoisomer of 1-lithio-2,4-dimethyloctane, the two stereogenic centres of which were introduced with high selectivity by alkylations of the amide enolates from the appropriate enantiomers of pseudoephedrine. (2S,3R,7R,9S)-3,7,9-Trimethyl-2-tridecyl acetate (SRRS-5Ac) has recently been found to be the major component of the female sex pheromone of Macrodiprion nemoralis (Hymenoptera: Diprionidae). A synthetic method for the preparation of a sixteen isomer mixture of 5Ac is also presented. This mixture has been found to be biologically active in field tests.
  • 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.
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