3-butene-1,2-diol monoacetate | 40390-49-6

• 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: 3-butene-1,2-diol monoacetate
• 英文别名: 4-acetoxy-3-hydroxy-1-butene；3-hydroxy-4-acetoxy-1-butene；4-Acetoxy-3-hydroxy-1-buten；2-Hydroxybut-3-enyl acetate
• CAS: 40390-49-6
• 化学式: C₆H₁₀O₃
• 分子量: 130.144
• InChiKey: YDRQWVZQEWLPTB-UHFFFAOYSA-N

物化性质

• 沸点：
  206.3±28.0 °C(Predicted)
• 密度：
  1.049±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.1
• 重原子数：
  9
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  10-Diazo-3,12,12-trimethyl-3-azatetracyclo[6.4.1.01,11.04,13]trideca-4,6,8(13)-triene-2,9-dione 、 3-butene-1,2-diol monoacetate 在 rhodium(II) acetate dimer 、 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成 2-[(3,12,12-Trimethyl-2,9-dioxo-3-azatricyclo[6.4.1.04,13]trideca-4,6,8(13),10-tetraen-10-yl)oxy]but-3-enyl acetate
  参考文献：
  名称：

  Welwitindolinone C synthetic studies. Construction of the welwitindolinone carbon skeleton via a transannular nitrone cycloaddition

  摘要：

  Described is the construction of the N-methylwelwitindolinone C core via an efficient strategy that employs a sequential rhodium carbenoid-mediated O-H insertion, Claisen rearrangement and transannular [3+2] nitrone cycloaddition. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2010.04.131
• 作为产物：
  描述：

  溶剂黄146 、 1,3-丁二烯 在 氧气 作用下， 生成 1-hydroxybut-3-en-2-yl acetate 、 3,4-双乙酸基-1丁烯 、 3-butene-1,2-diol monoacetate
  参考文献：
  名称：

  JP2023/167909

  摘要：

  公开号：

文献信息

• Method for producing allyl compound, and ether or ester compound produced thereby
  申请人：MITSUBISHI CHEMICAL CORPORATION

  公开号：US20040147757A1

  公开（公告）日：2004-07-29

  A method for producing an allyl compound having a compositional formula different from that of an allyl starting material compound, which comprises reacting the allyl starting material compound with an oxygen nucleophilic agent in the presence of a catalyst containing at least one transition metal compound containing a transition metal selected from the group consisting of transition metals belonging to Group 8 to Group 10 of the Periodic Table and a multidentate phosphite compound.

  一种生产具有与烯丙基起始物质化合物不同的组成式的烯丙基化合物的方法，包括在存在至少一种含有从周期表第8组到第10组的过渡金属属于的过渡金属的过渡金属化合物和多齿膦酸酯化合物的催化剂的情况下，将烯丙基起始物质化合物与氧亲核试剂反应。
• Polymers of 3-butene esters, their preparation and use
  申请人：Eastman Chemical Company

  公开号：US20010051690A1

  公开（公告）日：2001-12-13

  The specification describes various polymers having monomer of formula (I): 1 In formula (I), R1 and R2 are, independently, hydrogen, a C 1 -C 24 alkyl group, an aromatic or heteroaromatic group, a C 3 -C 8 cycloalkyl or C 2 -C 7 heterocycloalkyl group, or a —C(O)R3 group in which R3 is a C 1 -C 24 alkyl group, an aromatic or heteroaromatic group, a C 3 -C 8 cycloalkyl or C 2 -C 7 heterocyclic group; or a —CH 2 —C(O)—R4 group in which R4 is a C 1 -C 6 alkyl group. At least one of R1 and R2 is a —C(O)R3 group. The polymer may be a homopolymer or a copolymer containing other ethylenically unsaturated monomers. The polymer may be used in a variety of coating compositions such as inks, adhesives, paints and films. Unique monomers where both R1 and R2 are acetoacetyl groups and novel monomers where R2 is an acetoacetyl group are also described.

  该规范描述了具有式(I)的单体的各种聚合物： 在式(I)中，R1和R2分别是氢、C1-C24烷基、芳香或杂芳基、C3-C8环烷基或C2-C7杂环烷基、或者—C(O)R3基团，其中R3是C1-C24烷基、芳香或杂芳基、C3-C8环烷基或C2-C7杂环基；或者—CH2—C(O)—R4基团，其中R4是C1-C6烷基。R1和R2中至少有一个是—C(O)R3基团。该聚合物可以是同聚物或含有其他乙烯基不饱和单体的共聚物。该聚合物可用于各种涂料组合物，如油墨、粘合剂、油漆和薄膜。还描述了R1和R2均为乙酰乙酰基团的独特单体以及R2为乙酰乙酰基团的新型单体。
• PROCESSES FOR THE PREPARATION OF ORGANIC DIESTERS
  申请人：DAICEL CHEMICAL INDUSTRIES, Ltd.

  公开号：EP1044955A1

  公开（公告）日：2000-10-18

  The present invention relates a method of preparing an organic diester which comprises a first step (1) whom a diolefin and a peracid compound are allowed to react to synthesize a monoepoxide, a second step (2) wherein said synthesized monoepoxide is allowed to react with water and carboxylic acid and a third step (3) where the synthesized compounds are allowed to react with an acid anhydride. The present invention also relates to a method of preparing an organic diester wherein in the second step (2), the molar ratio of water and carboxylic acid added into monoepoxide is more than 2 and not more than 20, to an organic diester preparing method wherein monoepoxide is allowed to react with water in the second step (2) and to a method of preparing an organic diester wherein in the second step (2), water and carboxylic acid are removed from the synthesized product and recycled to be used again in said second step (2). The purpose of the present invention is to provide a method of preparing an organic diester having a good selectivity a producing few impurities and using diolefin as a starting material. In the second step (2), when water and carboxylic acid are recycled and used again, it is possible to reduce the load of dumping water and particularly, when 1, 3-butadiene is used as diolefin, acetic acid is used as carboxylic acid and acetic anhydride is used as an acid anhydride it is also possible to reduce the use amount of acetic acid.

  本发明涉及制备有机二酯的方法，包括第一步（1），在该步骤中，将二烯和过氧化物化合物反应以合成单环氧化物；第二步（2），在该步骤中，将合成的单环氧化物与水和羧酸反应；第三步（3），将合成的化合物与酸酐反应。本发明还涉及一种制备有机二酯的方法，其中在第二步（2）中，加入到单环氧化物中的水和羧酸的摩尔比大于2且不大于20；一种有机二酯制备方法，其中单环氧化物在第二步（2）中与水反应；以及一种制备有机二酯的方法，其中在第二步（2）中，从合成的产物中去除水和羧酸并回收以再次使用。本发明的目的是提供一种制备有机二酯的方法，该方法具有良好的选择性，产生少量杂质，并使用二烯作为起始材料。在第二步（2）中，当水和羧酸被回收并再次使用时，可以减少倾倒水的负担，特别是当1,3-丁二烯被用作二烯，乙酸被用作羧酸，乙酸酐被用作酸酐时，也可以减少乙酸的使用量。
• METHOD FOR PRODUCING HYDRIDE USING UNSATURATED COMPOUND HAVING CARBON NUMBER OF 4 AS RAW MATERIAL
  申请人：Mitsubishi Chemical Corporation

  公开号：US20140135511A1

  公开（公告）日：2014-05-15

  The present invention relates to a method for producing a hydride having a carbon number of 4, comprising contacting, in liquid phase, an unsaturated compound having a carbon number of 4 as a raw material with a solid catalyst obtained by loading a metal element belonging to Groups 9 to 11 of the long periodic table on a support, thereby performing hydrogenation to produce a corresponding hydride having a carbon number of 4, wherein hydrogenation is performed in the presence of, as a solvent, a 1,4-butanediol having a nitrogen component concentration of 1 ppm by weight to 1 wt % in terms of nitrogen atom.

  本发明涉及一种制备碳数为4的氢化物的方法，包括将碳数为4的不饱和化合物作为原料与在载体上负载属于长周期表中9至11族金属元素的固体催化剂在液相中接触，从而进行加氢反应以生成相应的碳数为4的氢化物。其中，在存在1,4-丁二醇作为溶剂的情况下进行加氢反应，1,4-丁二醇中的氮组分浓度为1 ppm重量至1重量％，以产生碳数为4的相应氢化物。
• Method for producing allyl compound
  申请人：MITSUBISHI CHEMICAL CORPORATION

  公开号：US20040092777A1

  公开（公告）日：2004-05-13

  A method for producing an allyl compound having a compositional formula different from that of an allyl starting material compound, which comprises reacting the allyl starting material compound with an oxygen nucleophilic agent having a structure different from that of the allyl starting material compound in the presence of a catalyst containing at least one transition metal compound containing a transition metal selected from the group consisting of transition metals belonging to Group 8 to Group 10 of the Periodic Table and a monodentate phosphite compound having a structure of the following formula (1): P(OR 1 )(OR 2 )(OR 3 )   (1) wherein R 1 , R 2 and R 3 are respectively independently an alkyl group which may have a substituent, carbon chains of R 1 , R 2 and R 3 may have at least one carbon-carbon double bond or triple bond, and at least two optional groups of R 1 , R 2 and R 3 may bond to each other to form at least one cyclic structure.

  一种制备具有与烯丙基起始材料化合物不同组成式的烯丙基化合物的方法，包括在至少包含选择自周期表8至10族过渡金属的过渡金属化合物和具有以下式（1）结构的单齿磷酸酯化合物催化剂存在下，将烯丙基起始材料化合物与具有不同于烯丙基起始材料化合物的结构的氧亲核试剂反应，其中式（1）中，R1、R2和R3分别独立地是可以具有取代基的烷基，R1、R2和R3的碳链可以具有至少一个碳-碳双键或三键，并且R1、R2和R3的至少两个可选基团可以结合形成至少一个环状结构。