allyl-nonyl-malonic acid diethyl ester | 176376-79-7

• 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: allyl-nonyl-malonic acid diethyl ester
• 英文别名: Allyl-nonyl-malonsaeure-diaethylester；diethyl allyl(nonyl)malonate；diethyl 2-nonyl-2-prop-2-enylpropanedioate
• CAS: 176376-79-7
• 化学式: C₁₉H₃₄O₄
• 分子量: 326.477
• InChiKey: NSDPAKXQPXNRPR-UHFFFAOYSA-N

物化性质

• 沸点：
  363.9±22.0 °C(Predicted)
• 密度：
  0.948±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  6.5
• 重原子数：
  23
• 可旋转键数：
  16
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.79
• 拓扑面积：
  52.6
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  allyl-nonyl-malonic acid diethyl ester 生成 2-nonyl-pent-4-enoic acid
  参考文献：
  名称：

  Browning; Woodrow; Adams, Journal of the American Chemical Society, 1930, vol. 52, p. 1282

  摘要：

  DOI：
• 作为产物：
  描述：

  烯丙基丙二酸二乙酯 在 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 反应 5.0h， 生成 allyl-nonyl-malonic acid diethyl ester
  参考文献：
  名称：

  Allyl as Protective Group for the Acidic Hydrogen of Malonic Ester

  摘要：

  DOI：

  10.1021/jo9600767

文献信息

• Titanium catalyst and organotitanium reacting reagent, production thereof, and reaction thereby
  申请人：Sato Fumie

  公开号：US06867161B1

  公开（公告）日：2005-03-15

  A titanium catalyst for reaction between a compound having a carbon-carbon unsaturated bond and a compound having an electrophilic functional group or an electrophilic reagent, said titanium catalyst being composed of a titanium compound represented by the formula (1) below TiX 1 X 2 X 3 X 4 (1) (where X 1 , X 2 , X 3 , and X 4 denote independently a halogen atom, C 1-20 alkoxyl group, aralkyloxy group, aryloxy group, or —NRxRy group (where Rx and Ry denote independently a C 1-20 alkyl group or aralkyl group), and any two of X 1 , X 2 , X 3 , and X 4 may form a ring.) and a Grignard reagent represented by the formula (2) below in a molar amount 1.5-2.5 times as much as the titanium compound. R 1 MgX 5 (2) (where R 1 denotes a C 2-10 alkyl group having a hydrogen atom at the β position and X 5 denotes a halogen atom.) The titanium catalyst of the present invention activates the carbon-carbon unsaturated bond, which has a comparatively low reactivity, thereby catalyzing the reaction with an electrophilic functional group. It is inexpensive and industrially advantageous. When applied to reaction between a compound having a carbon-carbon unsaturated bond and an electrophilic functional group, it yields industrially a variety of adducts of a compound having a carbon-carbon unsaturated bond and a compound having an electrophilic functional group, and it also yields a variety of intramolecular adducts of a compound having a carbon-carbon unsaturated bond and an electrophilic functional group in the same molecule.

  一种钛催化剂，用于在具有碳-碳不饱和键的化合物和具有电子亲合性官能团或电子亲合试剂的化合物之间进行反应，所述钛催化剂由下式（1）所表示的钛化合物和下式（2）所表示的格氏试剂组成，其中格氏试剂的摩尔量是钛化合物的1.5-2.5倍。 TiX1X2X3X4（1）（其中X1、X2、X3和X4独立表示卤素原子、C1-20烷氧基团、芳基氧基团或-NRxRy基团（其中Rx和Ry独立表示C1-20烷基或芳基烷基基团），X1、X2、X3和X4中的任意两个可以形成环。） R1MgX5（2）（其中R1表示在β位具有氢原子的C2-10烷基基团，X5表示卤素原子。） 本发明的钛催化剂激活了碳-碳不饱和键，具有相对较低的反应性，从而催化了与电子亲合性官能团的反应。它是廉价且具有工业优势的。当应用于具有碳-碳不饱和键和电子亲合性官能团之间的反应时，它产生了具有碳-碳不饱和键和电子亲合性官能团的化合物的各种加合物，并且还产生了同一分子中具有碳-碳不饱和键和电子亲合性官能团的各种分子内加合物。
• TITANIUM CATALYST, ORGANOTITANIUM REACTION REAGENT, PROCESSES FOR PRODUCING THESE, AND METHOD OF REACTION USING THESE
  申请人：NISSAN CHEMICAL INDUSTRIES, LIMITED

  公开号：EP0820809A1

  公开（公告）日：1998-01-28

  A titanium catalyst for reaction between a carbon-carbon unsaturated bond and a compound having an electrophilic functional group or an electrophilic reagent, said titanium catalyst being composed of a titanium compound represented by the formula (1) below         TiX1X2X3X4     (1) (where X1, X2, X3, and X4 denote independently a halogen atom, C1-20 alkoxyl group, aralkyloxy group, aryloxy group, or -NRxRy group (where Rx and Ry denote independently a C1-20 alkyl group or aralkyl group), and any two of X1, X2, X3, and X4 may form a ring.) and a Grignard reagent represented by the formula (2) below in a molar amount 1.5-2.5 times as much as the titanium compound.         R1MgX5     (2) (where R1 denotes a C2-10 alkyl group having a hydrogen atom at the β position and X5 denotes a halogen atom.) The titanium catalyst of the present invention activates the carbon-carbon unsaturated bond, which has a comparatively low reactivity, thereby catalyzing the reaction with an electrophilic functional group. It is inexpensive and industrially advantageous. When applied to reaction between a carbon-carbon unsaturated bond and an electrophilic functional group, it yields industrially a variety of adducts of a compound having a carbon-carbon unsaturated bond and a compound having an electrophilic functional group, and it also yields a variety of intramolecular adducts of a compound having a carbon-carbon unsaturated bond and an electrophilic functional group in the same molecule.

  一种钛催化剂，用于碳-碳不饱和键与具有亲电官能团或亲电试剂的化合物之间的反应，所述钛催化剂由下式（1）表示的钛化合物组成 TiX1X2X3X4 (1) (其中 X1、X2、X3 和 X4 独立地表示卤素原子、C1-20 烷氧基、芳氧基、芳烷氧基或 -NRxRy 基团（其中 Rx 和 Ry 独立地表示 C1-20 烷基或芳烷基），且 X1、X2、X3 和 X4 中的任意两个可形成一个环）和下式（2）表示的格氏试剂，其摩尔量为钛化合物的 1.5-2.5 倍。 R1MgX5 (2) (其中 R1 表示在 β 位有一个氢原子的 C2-10 烷基，X5 表示卤素原子)。 本发明的钛催化剂可激活反应活性相对较低的碳-碳不饱和键，从而催化亲电官能团反应。这种催化剂价格低廉，具有工业优势。当应用于碳-碳不饱和键与亲电官能团之间的反应时，它可在工业上生成具有碳-碳不饱和键的化合物与具有亲电官能团的化合物的各种加合物，还可在同一分子中生成具有碳-碳不饱和键的化合物与具有亲电官能团的化合物的各种分子内加合物。
• BERES J. A.; KURLICK N. J.; SHAFFER S. E.; VARNER M. G., EUR. J. MED. CHEM.-CHIM. THER., 1980, 15, NO 6, 571-573
  作者：BERES J. A.、 KURLICK N. J.、 SHAFFER S. E.、 VARNER M. G.

  DOI：——

  日期：——
• US6867161B1
  申请人：——

  公开号：US6867161B1

  公开（公告）日：2005-03-15
• Allyl as Protective Group for the Acidic Hydrogen of Malonic Ester
  作者：Takanori Yamazaki、Aleksandr Kasatkin、Yasufumi Kawanaka、Fumie Sato

  DOI：10.1021/jo9600767

  日期：1996.1.1