4-acetoxydecane

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 4-acetoxydecane
• 英文别名: (+/-)-decan-4-yl acetate；4-Decanol, acetate；decan-4-yl acetate
• 化学式: C₁₂H₂₄O₂
• 分子量: 200.321
• InChiKey: RNHJYRBCRUYROP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  14
• 可旋转键数：
  9
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  乙酸酐 、 4-正癸醇 在 4-二甲氨基吡啶 、 三乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 2.0h， 以43%的产率得到4-acetoxydecane
  参考文献：
  名称：

  A novel lipase enzyme panel exhibiting superior activity and selectivity over lipase B from Candida antarctica for the kinetic resolution of secondary alcohols

  摘要：

  A novel, commercially available lipase enzyme panel performing kinetic bioresolutions of a number of secondary alcohols is reported. The secondary alcohols that have been chosen are known from the literature to be particularly challenging substrates to resolve. Following initial screening, four co-solvents were investigated for each lead enzyme in an effort to assess their tolerance to common organic solvents. The superiority of these novel enzymes over lipase B from Candida antarctica (CALB) has been demonstrated. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2012.03.013

文献信息

• Dinuclear μ-alkylidene complexes of transition metals as models for the transformation of CH2X2 (X = Cl, Br, I) into malonic acid derivatives by double carbonylation reactions
  作者：B. Denise、D. Navarre、H. Rudler、J.C. Daran

  DOI：10.1016/0022-328x(89)85121-6

  日期：1989.10

  mechanisms of both reactions are discussed. From the fraction involving 1 a mononuclear complex resulting from the dimerization of ketene has been isolated, and its structure established by an X-ray diffraction study. Olefins such as ethene and norbornene are able to trap the ketene intermediate. The possible participation of such μ-alkylidene complexes in the direct transformation of CH2X2 (X = Cl,

  在各种条件下研究了μ-亚烷基络合物Fe 2（CO）8 CH 2）（1）和Pd 2 I 2（PPh 2 CH 2 PPh 2）2 CH 2（2）的羰基化。在醇ROH的存在下，配合物1主要产生单羰基化产物乙酸盐CH 3 CO 2 R，而在相同条件下，配合物2得到丙二酸酯CH 2（CO 2 R）2。，二羰基化的产物。讨论了两种反应的机理。从涉及1的馏分中分离出了由烯酮二聚化得到的单核络合物，并通过X射线衍射研究确定了其结构。烯烃（例如乙烯和降冰片烯）能够捕获烯酮中间体。讨论了此类μ-亚烷基络合物可能参与CH 2 X 2（X = Cl，Br，I）直接转化为丙二酸衍生物的过程。
• CONTINUOUS PROCESS FOR PREPARING (METH)ACRYLATES OF C10- ALCOHOL MIXTURES
  申请人：BASF SE

  公开号：US20140135523A1

  公开（公告）日：2014-05-15

  A continuous process for preparing (meth)acrylates of C 10 -alcohol mixtures by reaction of glacial (meth)acrylic acid with an isomer mixture of C 10 -alcohols composed of 2-propylheptanol as the main isomer and at least one of the C 10 -alcohols 2-propyl-4-methylhexanol, 2-propyl-5-methylhexanol, 2-isopropylheptanol, 2-isopropyl-4-methylhexanol, 2-isopropyl-5-methylhexanol and/or 2-propyl-4,4-dimethylpentanol, and the use of a diester of dicarboxylic acids which have been esterified with N-oxyl-containing compounds as polymerization inhibitors in such a process.

  通过将冰冷的（甲基）丙烯酸与由2-丙基庚醇异构体混合物反应制备C10-醇混合物的（甲基）丙烯酸酯的连续过程，其中以2-丙基庚醇为主要异构体，至少包括以下C10-醇之一：2-丙基-4-甲基己醇，2-丙基-5-甲基己醇，2-异丙基庚醇，2-异丙基-4-甲基己醇，2-异丙基-5-甲基己醇和/或2-丙基-4,4-二甲基戊醇，并在这种过程中使用已与含N-氧基的化合物酯化的二羧酸二酯作为聚合抑制剂。
• A novel lipase enzyme panel exhibiting superior activity and selectivity over lipase B from Candida antarctica for the kinetic resolution of secondary alcohols
  作者：Maeve O’Neill、Denis Beecher、David Mangan、Andrew S. Rowan、Agnieszka Monte、Stefan Sroka、Jan Modregger、Bhupinder Hundle、Thomas S. Moody

  DOI：10.1016/j.tetasy.2012.03.013

  日期：2012.4

  A novel, commercially available lipase enzyme panel performing kinetic bioresolutions of a number of secondary alcohols is reported. The secondary alcohols that have been chosen are known from the literature to be particularly challenging substrates to resolve. Following initial screening, four co-solvents were investigated for each lead enzyme in an effort to assess their tolerance to common organic solvents. The superiority of these novel enzymes over lipase B from Candida antarctica (CALB) has been demonstrated. (C) 2012 Elsevier Ltd. All rights reserved.
• Selective formation of malonate by a double CO insertion reaction into a μ-alkylidene complex of palladium
  作者：B. Denise、D. Navarre、H. Rudler

  DOI：10.1016/0022-328x(87)80171-7

  日期：1987.6
• DENO N. C.; GLADFELTER E. J.; POHL D. G., J. ORG. CHEM., 1979, 44, NO 21, 3728-3729
  作者：DENO N. C.、 GLADFELTER E. J.、 POHL D. G.

  DOI：——

  日期：——