2,2-Bis[(2-oxo-1,3-dioxolane-4-carbonyl)oxymethyl]butyl 2-oxo-1,3-dioxolane-4-carboxylate | 1352430-25-1

• 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: 2,2-Bis[(2-oxo-1,3-dioxolane-4-carbonyl)oxymethyl]butyl 2-oxo-1,3-dioxolane-4-carboxylate
• CAS: 1352430-25-1
• 化学式: C₁₈H₂₀O₁₅
• 分子量: 476.348
• InChiKey: BQJBGHZAPMRRJE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  33
• 可旋转键数：
  13
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  186
• 氢给体数：
  0
• 氢受体数：
  15

反应信息

• 作为产物：
  描述：

  三羟甲基丙烷 、 4-methoxycarbonyl-2-oxo-1,3-dioxolane 在 Novozym 435 作用下， 反应 72.0h， 生成 2,2-Bis[(2-oxo-1,3-dioxolane-4-carbonyl)oxymethyl]butyl 2-oxo-1,3-dioxolane-4-carboxylate
  参考文献：
  名称：

  2-Oxo-1, 3-dioxolane-4-carboxylic Acid and Derivatives Thereof, Their Preparation and Use

  摘要：

  2-氧代-1,3-二氧杂环戊二酮-4-羧酸及其衍生物，根据以下公式，其中R1代表负电荷、氢或可能是甲基或乙基或一个n价基团，该基团最多可被n-1个进一步的2-氧代-1,3-二氧杂环戊二酮-4-羧基取代，以及一种通过相应环氧化物的羧化制备它们的方法，一种它们的酯交换反应方法，以及它们用于制备羟基脲和作为胺基阻滞剂的末端基团的用途。

  公开号：

  US20110313177A1

文献信息

• [EN] 2-HYDROXYETHYL 2-OXO-1, 3-DIOXOLANE-4-CARBOXYLATES, THEIR PREPARATION AND USE<br/>[FR] 2-OXO-1,3-DIOXOLANE-4-CARBOXYLATES DE 2-HYDROXYÉTHYLE, LEUR PRÉPARATION ET UTILISATION
  申请人：CONSTR RES & TECH GMBH

  公开号：WO2015132080A1

  公开（公告）日：2015-09-11

  The present invention suggests 2-hydroxyethyl 2-oxo-1,3-dioxolane-4-carboxylates of formula (I): (I) wherein one of R1 and R2 can be hydrogen. In particular, R1 and R2, if not hydrogen, and in each case independently of one another, are selected from straight-chain, branched or cyclic C1-22-alkyl groups, preferably C1-12-alkyl groups, C6-12-aryl groups, C6-18-aralkyl groups and C6-18-alkaryl groups, wherein R1 and/or R2, in each case independently of one another, may comprise at least one additional functional group, selected from hydroxyl groups, ether groups, ester groups, epoxy groups, and double bonds, and wherein R2 may be substituted with up to 10, preferably with 1 to 5, and in particular with 1or 2 further 2-hydroxyethyl2-OXO-1,3- dioxolane-4-carboxylic groups. The 2-hydroxyethyl 2-oxo-1,3-dioxolane-4-carboxylates can be prepared by reacting 2-oxo-1,3-dioxolane-4-carboxylic acid with epoxides and can be used for the preparation of hydroxyurethanes through reaction with amines, such as amine hardeners. Moreover, they can also be used as end groups for the blocking of amines.

  本发明提出了式(I)的2-羟乙基2-氧代-1,3-二噁烷-4-羧酸酯：（I），其中R1和R2中的一个可以是氢。特别地，如果R1和R2不是氢，那么它们分别独立地选自直链、支链或环状C1-22烷基、优选为C1-12烷基、C6-12芳基、C6-18芳基烷基和C6-18烷基芳基，其中R1和/或R2，分别独立地，可能包括至少一个额外的功能基团，选自羟基、醚基、酯基、环氧基和双键，且R2可能被取代为最多10个，优选为1到5个，特别为1或2个进一步的2-羟乙基2-氧代-1,3-二噁烷-4-羧酸基团。2-羟乙基2-氧代-1,3-二噁烷-4-羧酸酯可通过将2-氧代-1,3-二噁烷-4-羧酸与环氧化物反应制备，并可用于通过与胺类化合物（例如胺固化剂）反应制备羟基脲。此外，它们还可用作阻断胺类化合物的末端基团。
• 2-Oxo-1, 3-dioxolane-4-carboxylic Acid and Derivatives Thereof, Their Preparation and Use
  申请人：MECFEL-MARCZEWSKI Joanna

  公开号：US20110313177A1

  公开（公告）日：2011-12-22

  2-Oxo-1,3-dioxolane-4-carboxylic acid and derivatives thereof, according to the following formula, in which R 1 represents a negative charge, hydrogen or may be methyl or ethyl or an n-valent radical, which may be substituted with at most n−1 further 2-oxo-1,3-dioxolane-4-carboxyl groups, as well as a process for their preparation by means of carboxylation of the corresponding epoxides, a process for their transesterification and their use for the preparation of hydroxyurethanes and as end groups for the blocking of amines.

  2-氧代-1,3-二氧杂环戊二酮-4-羧酸及其衍生物，根据以下公式，其中R1代表负电荷、氢或可能是甲基或乙基或一个n价基团，该基团最多可被n-1个进一步的2-氧代-1,3-二氧杂环戊二酮-4-羧基取代，以及一种通过相应环氧化物的羧化制备它们的方法，一种它们的酯交换反应方法，以及它们用于制备羟基脲和作为胺基阻滞剂的末端基团的用途。
• 2-Hydroxyethyl 2-oxo-1,3-dioxolane-4-carboxylates, their preparation and use
  申请人：Construction Research & Technology GmbH

  公开号：EP2915808A1

  公开（公告）日：2015-09-09

  The present invention suggests 2-hydroxyethyl 2-oxo-1,3-dioxolane-4-carboxylates of formula (I): wherein one of R1 and R2 can be hydrogen. In particular, R1 and R2, if not hydrogen, and in each case independently of one another, are selected from straight-chain, branched or cyclic C1-22-alkyl groups, preferably C1-12-alkyl groups, C6-12-aryl groups, C6-18-aralkyl groups and C6-18-alkaryl groups, wherein R1 and/or R2, in each case independently of one another, may comprise at least one additional functional group, selected from hydroxyl groups, ether groups, ester groups, epoxy groups, and double bonds, and wherein R2 may be substituted with up to 10, preferably with 1 to 5, and in particular with 1 or 2 further 2-hydroxyethyl 2-oxo-1,3-dioxolane-4-carboxylic groups. The 2-hydroxyethyl 2-oxo-1,3-dioxolane-4-carboxylates can be prepared by reacting 2-oxo-1,3-dioxolane-4-carboxylic acid with epoxides and can be used for the preparation of hydroxyurethanes through reaction with amines, such as amine hardeners. Moreover, they can also be used as end groups for the blocking of amines.

  本发明提出了式(I)的 2-羟乙基 2-氧代-1,3-二氧戊环-4-羧酸酯： 其中 R1 和 R2 中的一个可以是氢。特别是，R1 和 R2（如果不是氢，且在每种情况下彼此独立）选自直链、支链或环状 C1-22 烷基，优选 C1-12 烷基、C6-12-芳基、C6-18-芳基和 C6-18- 烷芳基，其中 R1 和/或 R2 在每种情况下彼此独立、其中 R1 和/或 R2，在每种情况下彼此独立，可包含至少一个额外的官能团，选自羟基、醚基、酯基、环氧基和双键，其中 R2 可被最多 10 个，优选 1 至 5 个，特别是 1 或 2 个额外的 2-羟乙基 2-氧代-1,3-二氧戊环-4-羧基取代。 2- 羟乙基 2-氧代-1,3-二氧戊环-4-羧酸酯可通过 2-氧代-1,3-二氧戊环-4-羧酸与环氧化物反应制备，并可通过与胺（如胺固化剂）反应用于制备羟基聚氨酯。此外，它们还可用作胺封端基团。
• Agrochemical adjuvant containing 2-oxo-1,3-dioxolan-4 carboxylates
  申请人：BASF SE

  公开号：US10219515B2

  公开（公告）日：2019-03-05

  The present invention relates to a method for preparing a tank mix, which comprises the step of contacting a pesticide formulation, water, and a tank mix adjuvant which comprises a carbonate of the formula (I); to a pesticide formulation comprising the tank mix adjuvant; to a method of controlling phytopathogenic fungi and/or undesired vegetation and/or undesired insect or mite attack and/or for regulating the growth of plants, wherein the tank mix or the pesticide formulation is allowed to act on the respective pests, their environment or the plants to be protected from the respective pest, on the soil and/or on undesired plants and/or the crop plants and/or their environment; and to a use of the tank mix adjuvant for increasing the efficacyl of a pesticide.

  本发明涉及一种制备罐装混合物的方法，该方法包括将农药制剂、水和罐装混合物 佐剂（包括式（I）的碳酸盐）接触的步骤；涉及一种包含罐装混合物佐剂的农药制剂；一种控制植物病原真菌和/或有害植被和/或有害昆虫或螨虫侵袭和/或调节植物生长的方法，其中混合液或农药制剂可作用于相应的害虫、害虫环境或需保护免受相应害虫侵袭的植物、土壤和/或有害植物和/或作物植物和/或其环境；以及混合液佐剂用于提高农药的功效。
• 2-HYDROXYETHYL 2-OXO-1,3-DIOXOLANE-4-CARBOXYLATES, THEIR PREPARATION AND USE
  申请人：CONSTRUCTION RESEARCH & TECHNOLOGY GMBH

  公开号：US20170008871A1

  公开（公告）日：2017-01-12

  2-hydroxyethyl 2-oxo-1,3-dioxolane-4-carboxylates of formula (I): wherein one of R 1 and R 2 can be hydrogen. R 1 and R 2 , if not hydrogen, and in each case independently of one another, are selected from straight-chain, branched or cyclic C 1-22 -alkyl groups, preferably C 1-12 -alkyl groups, C 6-12 -aryl groups, C 6-18 -aralkyl groups and C 6-18 -alkaryl groups, wherein R 1 and/or R 2 , in each case independently of one another, may comprise at least one additional functional group, selected from hydroxyl groups, ether groups, ester groups, epoxy groups, and double bonds, and wherein R 2 may be substituted with up to 10, preferably with 1 to 5, and in particular with 1 or 2 further 2-hydroxyethyl 2-oxo-1,3-dioxolane-4-carboxylic groups. The 2-hydroxyethyl 2-oxo-1,3-dioxolane-4-carboxylates can be prepared by reacting 2-oxo-1,3-dioxolane-4-carboxylic acid with epoxides and can be used for the preparation of hydroxyurethanes through reaction with amines, such as amine hardeners. Moreover, they can also be used as end groups for the blocking of amines.