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3,7-二甲基-6-辛烯基-3-甲基丁酸酯 | 68922-10-1

中文名称
3,7-二甲基-6-辛烯基-3-甲基丁酸酯
中文别名
——
英文名称
citronellyl isovalerate
英文别名
citronellyl 3-methylbutanoate;3,7-dimethyloct-6-enyl 3-methylbutanoate
3,7-二甲基-6-辛烯基-3-甲基丁酸酯化学式
CAS
68922-10-1
化学式
C15H28O2
mdl
——
分子量
240.386
InChiKey
WZTNQQJXPYEGAF-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:
    145-150 °C(Press: 14 Torr)
  • 密度:
    0.8818-0.8839 g/cm3(Temp: 15 °C)
  • LogP:
    5.578 (est)
  • 保留指数:
    1563;1563;1558;1558

计算性质

  • 辛醇/水分配系数(LogP):
    5
  • 重原子数:
    17
  • 可旋转键数:
    9
  • 环数:
    0.0
  • sp3杂化的碳原子比例:
    0.8
  • 拓扑面积:
    26.3
  • 氢给体数:
    0
  • 氢受体数:
    2

文献信息

  • [EN] DEGRADATION ACCELERATOR FOR POLYMERS AND POLYMER ARTICLE COMPRISING IT<br/>[FR] ACCÉLÉRATEUR DE DÉGRADATION POUR DES POLYMÈRES ET ARTICLE POLYMÈRE LE COMPRENANT
    申请人:CIBA HOLDING INC
    公开号:WO2009016083A1
    公开(公告)日:2009-02-05
    Disclosed are a method for improving the degradation of natural and/or synthetic polymers or a polymer article made from such polymer(s) by light and/or heat and/or humidity, comprising the incorporation of a compound of formula (I) into said natural and/or synthetic polymers: Formula (I); wherein m is 1 or 2, n is 1 to 100, X is selected from certain benzophenone-derived moieties and R, R1; R2 are each selected from list of certain residues; novel compounds of said formula (I) and polymeric articles of improved degradability in the presence of light and/or heat and/or humidity being made of a composition comprising: A) a natural and/or a synthetic polymer and B) a degradation accelerator being a compound of said formula (I).
    公开了一种改善天然和/或合成聚合物或由这些聚合物制成的聚合物制品在光线和/或热量和/或湿度作用下降解的方法,包括将式(I)的化合物并入所述天然和/或合成聚合物中:式(I);其中m为1或2,n为1至100,X从特定苯基酮衍生物中选择,R,R1,R2分别从特定残基列表中选择;所述式(I)的新化合物和在存在光线和/或热量和/或湿度时具有改善降解性能的聚合物制品由包括以下成分的组合物制成:A) 天然和/或合成聚合物和B) 一种降解加速剂,该加速剂是所述式(I)的化合物。
  • Additive Mixtures for Agricultural Articles
    申请人:Gardi Stefano
    公开号:US20090076206A1
    公开(公告)日:2009-03-19
    An agricultural article made of a composition containing (a) an organic polymer, and (b) an additive mixture comprising the components (b-0) a photosensitizer, (b-I) an organic salt of a transition metal, and optionally (b-II) an inorganic peroxide or inorganic superoxide.
    一篇农业文章,由含有(a)有机聚合物和(b)添加剂混合物的组成物制成,包括组分(b-0)光敏剂,(b-I)过渡金属的有机盐,以及可选的(b-II)无机过氧化物或无机超氧化物。
  • ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES
    申请人:GARDI STEFANO
    公开号:US20110015295A1
    公开(公告)日:2011-01-20
    Disclosed are 2,6-bis[octadecyloxy]anthraquinone, 1-(4,6-bis[dibutylamino]-[1,3,5]-triazin-2-ylamino)-anthraquinone, 2-(4,6-bis[dibutylamino]-[1,3,5]-triazin-2-ylaminoyanthraquinone, 2,6-bis[4,6-bis[dibutylamino]-[1,3,5]-triazin-2-yloxy]-anthraquinone, 2-(2-ethyl-hexyloxy)-1-octadecyloxy-anthraquinone, 1,2-bis[octadecyloxy]anthraquinone, 1,2-bis[2-ethyl-hexyloxy]anthraquinone, 1,2-bis[octyloxy]anthraquinone, 1,5-bis[2-ethyl-hexyloxy]anthraquinone, 9,10-dioxo-9,10-dihydro-anthracene-2-sulfonic acid dodecylamide, 2,6-bis[stearoyloxy]anthraquinone and bis[9,10-dioxo-9,10-dihydro-anthracene-2-sulfonic acid]-1′,12′-dodecandiyldiamide. The anthraquinones are suitable additives for thermoplastic polymers or waxes and act as photosensitizers towards their degradation.
    揭示了2,6-双[辛基氧基]蒽醌,1-(4,6-双[二丁基氨基]-[1,3,5]-三嗪-2-基氨基)-蒽醌,2-(4,6-双[二丁基氨基]-[1,3,5]-三嗪-2-基氨氧基)蒽醌,2,6-双[4,6-双[二丁基氨基]-[1,3,5]-三嗪-2-基氧基]-蒽醌,2-(2-乙基-己氧基)-1-辛基氧基蒽醌,1,2-双[辛基氧基]蒽醌,1,2-双[2-乙基-己氧基]蒽醌,1,2-双[辛氧基]蒽醌,1,5-双[2-乙基-己氧基]蒽醌,9,10-二氧-9,10-二氢蒽-2-磺酸十二胺,2,6-双[硬脂酰氧基]蒽醌和双[9,10-二氧-9,10-二氢蒽-2-磺酸]-1′,12′-十二烷二胺。这些蒽醌是适用于热塑性聚合物或蜡的添加剂,并作为光敏剂促进它们的降解。
  • 4,8-Dimethyl-7-nonen-2-one and 4,8-dimethylnonan-2-one used as perfumes
    申请人:Surburg Horst
    公开号:US20060166857A1
    公开(公告)日:2006-07-27
    The use of 4,8-dimethyl-7-nonen-2-one and 4,8-dimethylnonan-2-one as fragrances with a rose odour is described. Corresponding perfume compositions, perfumed products and processes for producing or strengthening a rose odour are also described.
    本文描述了使用4,8-二甲基-7-壬酮和4,8-二甲基壬酮作为具有玫瑰香味的香料。同时还描述了相应的香水配方、带有香味的产品以及生产或加强玫瑰香味的过程。
  • Hair Processing Agent And Method For Permanent Waving Hair
    申请人:Shibuya Akira
    公开号:US20080085251A1
    公开(公告)日:2008-04-10
    Provided are hair processing agents capable of permanent waving hair even at a neutral to weakly acidic pH range that causes less irritation to the skin, and hair processing agents in which an unpleasant odor is masked. Hair processing agents contain at least one compound represented by the formula (2). Hair processing agents contain a compound of the formula (2) and at least one compound (ii) selected from thioglycolic acid, thiolactic acid, cysteine, acetylcysteine, cysteamine, acylcysteamine, salts thereof and ester derivatives thereof. Hair processing agents contain a compound of the formula (2), a surfactant and water, and are emulsified. Hair processing agents contain a compound of the formula (2) and a specific perfume. wherein X is a structure selected from —O—, —S—, —NH— and —NR 1 —; R 1 is an alkyl group of 1 to 6 carbon atoms; Y is an oxygen atom or a sulfur atom; in the formula (1), Z is a divalent organic residue having at least one mercapto group; in the formula (2), R is a divalent organic residue optionally having a mercapto group; and R 2 is a hydrogen atom or an alkyl group of 1 to 6 carbon atoms.
    提供了能够在中性至微酸性pH范围内进行永久性卷发的头发处理剂,其对皮肤刺激较小,并且掩盖了不愉快的气味。头发处理剂包含至少一种由公式(2)表示的化合物。头发处理剂包含公式(2)的化合物和至少一种从巯基乙酸,巯基乳酸,半胱氨酸,乙酰半胱氨酸,半胱氨醇,酰基半胱氨醇,其盐和酯衍生物中选择的化合物(ii)。头发处理剂包含公式(2)的化合物,表面活性剂和水,并且是乳化的。头发处理剂包含公式(2)的化合物和特定香水。其中X是从-O-,-S-,-NH-和-NR1-选择的结构;R1是1到6个碳原子的烷基;Y是氧原子或硫原子;在公式(1)中,Z是具有至少一个巯基的二价有机残基;在公式(2)中,R是二价的有机残基,可选地具有巯基;R2是氢原子或1到6个碳原子的烷基。
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表征谱图

  • 氢谱
    1HNMR
  • 质谱
    MS
  • 碳谱
    13CNMR
  • 红外
    IR
  • 拉曼
    Raman
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mass
cnmr
ir
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  • 峰位数据
  • 峰位匹配
  • 表征信息
Shift(ppm)
Intensity
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Assign
Shift(ppm)
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测试频率
样品用量
溶剂
溶剂用量
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