2-acetoxytridecane | 41015-28-5

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: 2-acetoxytridecane
• 英文别名: tridecan-2-yl acetate
• CAS: 41015-28-5
• 化学式: C₁₅H₃₀O₂
• 分子量: 242.402
• InChiKey: ZJSXXRKLMXNOCL-UHFFFAOYSA-N

物化性质

• 沸点：
  88 °C(Press: 0.2 Torr)
• 密度：
  0.865±0.06 g/cm3(Predicted)
• 保留指数：
  1631

计算性质

• 辛醇/水分配系数(LogP)：
  6.1
• 重原子数：
  17
• 可旋转键数：
  12
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.93
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-acetoxytridecane 以 丙酮 为溶剂， 反应 19.0h， 生成 (S)-(+)-tridecan-2-ol 、 1-甲基-1-十二烷醇
  参考文献：
  名称：

  Naoshima, Yoshinobu; Kamezawa, Makoto; Tachibana, Hojun, Journal of the Chemical Society. Perkin transactions I, 1993, # 5, p. 557 - 562

  摘要：

  DOI：
• 作为产物：
  描述：

  十二醛 在 吡啶 、 magnesium 作用下， 以 乙醚 为溶剂， 反应 32.0h， 生成 2-acetoxytridecane
  参考文献：
  名称：

  Enders, Dieter; Plant, Andrew, Liebigs Annalen der Chemie, 1991, # 11, p. 1241 - 1243

  摘要：

  DOI：

文献信息

• [EN] PHEROMONES<br/>[FR] PHEROMONES
  申请人：EAST MALLING RES LTD

  公开号：WO2006000798A1

  公开（公告）日：2006-01-05

  The apple leaf midge and raspberry cane midge pheromones have been found to be acetoxyheptadecenone and acetoxyundecanone, respectively, and uses for the related C_9-19 oxoalkyl or oxoalkenyl molecules substituted with a lower alkanoyloxy group are provided, including monitoring population levels of the midge and control of midge populations by disrupting mating patterns.

  苹果叶小蚜和覆盆子藤小蚜的信息素分别被发现为乙酰氧基庚烯酮和乙酰氧基十一酮，相关的C_9-19氧代烷基或氧代烯基分子被用于监测小蚜的种群水平，并通过破坏交配模式来控制小蚜种群。
• [EN] COMPOSITION HAVING MOGROSIDE SWEETNESS AND FLAVOR AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF<br/>[FR] COMPOSITION AYANT LA SAVEUR ET LE GOÛT SUCRÉ DU MOGROSIDE, SON PROCÉDÉ DE PRÉPARATION ET SON APPLICATION<br/>[ZH] 罗汉果苷甜味和风味组合物及其制备方法与应用
  申请人：HUNAN AIDALUN TECH CO LTD

  公开号：WO2021027056A1

  公开（公告）日：2021-02-18

  罗汉果苷甜味和风味组合物及其制备方法与应用。所述组合物包括有罗汉果芳香挥发油、罗汉果甜香脱色浓缩汁、罗汉果纯味脱色浓缩汁、罗汉果苷甜味成分中的至少一种，其中罗汉果甜香脱色浓缩汁、罗汉果纯味脱色浓缩汁和罗汉果苷甜味成分≠0。该组合物不含苦味物质，保留了罗汉果的风味和营养成分，具有浓郁的果香味和焦香味，具有接近蔗糖的清爽甜味和纯正口感，甜味持续时间短，甜味饱和度高，集罗汉果的香、甜、味、营养于一体；制备工艺简单，成本较低。罗汉果苷甜味和风味组合物可广泛应用于食品、饮品、乳品、保健品和药品等领域。
• Stabilization of long-chain intermediates in solution. Octyl radicals and cations
  作者：Aleksandar V. Teodorović、Dalibor M. Badjuk、Nenad Stevanović、Radoslav Z. Pavlović

  DOI：10.1016/j.molstruc.2013.02.020

  日期：2013.5

  The rearrangements of 1-octyl, 1-decyl and 1-tridecyl intermediates obtained from thermal lead(IV) acetate (LTA) decarboxylation of nonanoic, undecanoic and tetradecanoic acid were investigated experimentally through analysis and distribution of the products. The relationships between 1,5-, 1,6- and possibly existing 1,7-homolytic hydrogen transfer in 1-octyl-radical, as well as successive 1,2-hydride shift in corresponding cation have been computed via Monte-Carlo method. Taking into account that ratios of 1,5-/1,6-homolytic rearrangements in 1-octyl- and 1-tridecyl radical are approximately the same, the simulation shows very low involvement of 1,7-hydrogen rearrangement (1,5-/1,6-/1,7-hydrogen rearrangement = 85:31:1) in 1-octyl radical. (C) 2013 Elsevier B.V. All rights reserved.
• Tellurium in organic synthesis: the enantioselective synthesis of the pheromone blend components of Mayetiola destructor, Drosophila mulleri and Contarinia pisi
  作者：Renan S. Ferrarini、João V. Comasseto、Alcindo A. Dos Santos

  DOI：10.1016/j.tetasy.2009.08.003

  日期：2009.9

  The components of the pheromone blend of Mayetiola destructor, Drosophila mulleri, and Contarinia pisi were synthesized in high enantiomeric excess (99% ee) from a common enantiopure dianion prepared from an enantiopure hydroxytelluride. (C) 2009 Elsevier Ltd. All rights reserved.
• Biocatalytic synthesis of (S)-2-tridecanyl acetate and (S)-2-pentadecanyl acetate, aggregation pheromone components ofDrosophila mulleri andD. busckii, by enantioselective hydrolysis with lipase
  作者：Makoto Kamezawa、Hojun Tachibana、Takehiko Ohtani、Yoshinobu Naoshima

  DOI：10.1007/bf02059742

  日期：1994.5

  The two chiral pheromone acetates, (S)-2-tridecanyl acetate and (S)-2-pentadecanyl acetate, were synthesized with an enantiomeric excess (e.e.) of almost 100% by Pseudomonas cepacia lipase-catalyzed hydrolysis of their corresponding racemic acetates in an acetone-water solvent system.