Octadecyl-(3)-acetat | 95554-34-0

• 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: Octadecyl-(3)-acetat
• 英文别名: n-Octadecyl-(3)-acetat；acetic acid-(1-ethyl-hexadecyl ester)；Essigsaeure-(1-aethyl-hexadecylester)；Octadecan-3-yl acetate
• CAS: 95554-34-0
• 化学式: C₂₀H₄₀O₂
• 分子量: 312.536
• InChiKey: XYQLZCHPFUVHLZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.8
• 重原子数：
  22
• 可旋转键数：
  17
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.95
• 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：

  Octadecyl-(3)-acetat 在 Burkholderica cepacia amano lipase 作用下， 以 丙酮 为溶剂， 生成 (R)-3-octadecanol
  参考文献：
  名称：

  Synthesis of new (R)-secondary carbinols with different structures via enzymatic resolution

  摘要：

  The present study deals with the biocatalytic enantioselective synthesis of 19 new chiral alcohols with alkyl (C-11-C-19) and phenyl, substituted phenyl, heteroaromatic, and naphthyl groups 4a-4z with an (R)-configuration and high enantiomeric excess (similar to 100%). The corresponding ketones 1a-1z were synthesized and then reduced with NaBH4 to their racemic alcohols 2a-2z, which were converted into their racemic acetyl derivatives 3a-3z. Enzymes of four different types were used for the enantioselective hydrolysis of these acetyl compounds 3a-3z. The optimal reaction conditions for these four enzymes were established by investigating the enantiomeric excesses by chiral HPLC. Amano lipase from Burkholderica cepacia (Pseudomonas cepacia) AL-PS was determined as the best enzyme in this work This study presents an environmentally friendly and green chemistry method for the synthesis of these new (R)-chiral carbinols 4a-4z. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2011.07.017
• 作为产物：
  描述：

  3-辛癸酮 在 sodium tetrahydroborate 作用下， 以 四氢呋喃 、 甲醇 为溶剂， 反应 0.5h， 生成 Octadecyl-(3)-acetat
  参考文献：
  名称：

  Synthesis of new (R)-secondary carbinols with different structures via enzymatic resolution

  摘要：

  The present study deals with the biocatalytic enantioselective synthesis of 19 new chiral alcohols with alkyl (C-11-C-19) and phenyl, substituted phenyl, heteroaromatic, and naphthyl groups 4a-4z with an (R)-configuration and high enantiomeric excess (similar to 100%). The corresponding ketones 1a-1z were synthesized and then reduced with NaBH4 to their racemic alcohols 2a-2z, which were converted into their racemic acetyl derivatives 3a-3z. Enzymes of four different types were used for the enantioselective hydrolysis of these acetyl compounds 3a-3z. The optimal reaction conditions for these four enzymes were established by investigating the enantiomeric excesses by chiral HPLC. Amano lipase from Burkholderica cepacia (Pseudomonas cepacia) AL-PS was determined as the best enzyme in this work This study presents an environmentally friendly and green chemistry method for the synthesis of these new (R)-chiral carbinols 4a-4z. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2011.07.017

文献信息

• Fatty alcohols and esters for crude oil treatment
  申请人：Ecolab USA Inc.

  公开号：US10344230B2

  公开（公告）日：2019-07-09

  Compounds are provided that can be used in methods for reducing paraffin or wax deposition in crude oil during processing, storage, or transportation. More specifically, the method comprises contacting the crude oil with a composition in an amount effective to reduce paraffin or was deposition.

  所提供的化合物可用于在加工、储存或运输过程中减少原油中石蜡或蜡沉积的方法。更具体地说，该方法包括将原油与一定量的组合物接触，以有效减少石蜡或蜡的沉积。
• FATTY ALCOHOLS AND ESTERS FOR CRUDE OIL TREATMENT
  申请人：Ecolab USA Inc.

  公开号：US20180079977A1

  公开（公告）日：2018-03-22

  Compounds are provided that can be used in methods for reducing paraffin or wax deposition in crude oil during processing, storage, or transportation. More specifically, the method comprises contacting the crude oil with a composition in an amount effective to reduce paraffin or was deposition.
• [EN] FATTY ALCOHOLS AND ESTERS FOR CRUDE OIL TREATMENT<br/>[FR] ALCOOLS GRAS ET ESTERS POUR LE TRAITEMENT DE PÉTROLE BRUT
  申请人：ECOLAB USA INC

  公开号：WO2018053248A1

  公开（公告）日：2018-03-22

  Compounds are provided that can be used in methods for reducing paraffin or wax deposition in crude oil during processing, storage, or transportation. More specifically, the method comprises contacting the crude oil with a composition in an amount effective to reduce paraffin or was deposition.