1,4-苯二羧酸1-(2-乙基己基)酯 | 155603-50-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 1,4-苯二羧酸1-(2-乙基己基)酯
• 英文名称: Mono(2-ethylhexyl) terephthalate
• 英文别名: 4-(2-ethylhexoxycarbonyl)benzoic acid
• CAS: 155603-50-2
• 化学式: C₁₆H₂₂O₄
• 分子量: 278.34
• InChiKey: HRUJAEJKCNCOGW-UHFFFAOYSA-N

物化性质

• 熔点：
  106 - 108oC
• 沸点：
  411℃
• 密度：
  1.088
• 闪点：
  145℃
• 溶解度：
  可溶于氯仿（轻微）、甲醇（轻微、超声处理）

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  20
• 可旋转键数：
  9
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  63.6
• 氢给体数：
  1
• 氢受体数：
  4

安全信息

• 危险性防范说明：
  P261,P305+P351+P338
• 危险性描述：
  H315,H319,H335

文献信息

• [EN] PROCESS FOR PREPARING CARBOXYLIC ACID ESTERS IN THE PRESENCE OF A TITANIUM-CONTAINING CATALYST<br/>[FR] PROCÉDÉ DE PRÉPARATION D'ESTERS D'ACIDES CARBOXYLIQUES EN PRÉSENCE D'UN CATALYSEUR CONTENANT DU TITANE
  申请人：SIBUR HOLDING PUBLIC JOINT STOCK CO

  公开号：WO2016043616A1

  公开（公告）日：2016-03-24

  The present invention relates to a process for preparing carboxylic acid esters, comprising esterification of a carboxylic acid with an alcohol in the presence of a titanium-containing catalyst selected from compounds of a general formula, Tin(OR)x(OR')xOy, wherein n is an integer from 1 to 4; у is an integer from 0 to 6; x can be the same or different and is an integer from 2 to 8; R is a linear or branched C1-C18alkyl, C3-C18cycloalkyl, R' is aryl optionally comprising an electron-donor substituent; or a mixture thereof, with the proviso that if n is 1, then x is 2 and у is 0; and if n>1, then the compounds comprise at least two alkoxy groups and two aryloxy groups. The present invention also relates to a process for preparing carboxylic acid esters, wherein a compound of general formula (I) or (II), wherein q represents an integer of 1 to 4; Y is independently R or R'; or a mixture thereof, with the proviso that the compounds comprise at least two alkoxy groups and two aryloxy groups, is used as a catalyst. The claimed process allows to reduce the amount of a used catalyst and the time of the process duration, while increasing the conversion rate of initial reagents and the yield of a target product.

  本发明涉及一种制备羧酸酯的方法，包括在存在选择自通式Tin(OR)x(OR')xOy的化合物的钛催化剂的情况下，将羧酸与醇酯化，其中n为1至4的整数；у为0至6的整数；x可以相同也可以不同，为2至8的整数；R为线性或支链的C1-C18烷基，C3-C18环烷基，R'为芳基，可包含电子给体取代基；或二者的混合物，但若n为1，则x为2且у为0；若n>1，则化合物至少包含两个烷氧基和两个芳氧基。本发明还涉及一种制备羧酸酯的方法，其中通式(I)或(II)的化合物，其中q表示1至4的整数；Y独立地为R或R'；或二者的混合物，但化合物至少包含两个烷氧基和两个芳氧基，被用作催化剂。所述方法允许减少使用的催化剂量和过程持续时间，同时提高初始试剂的转化率和目标产品的产率。
• PLASTICIZER COMPOSITION AND RESIN COMPOSITION INCLUDING THE SAME
  申请人：LG CHEM, LTD.

  公开号：US20190047938A1

  公开（公告）日：2019-02-14

  The present invention relates to a plasticizer composition and a resin composition including the same, and can provide a plasticizer composition in which three types of terephthalate-based materials and three types of cyclohexane 1,4-diester-based materials are mixed, and by which environmental friendliness can be secured, mechanical properties such as tensile strength and an elongation rate, physical properties such as migration properties and volatile loss can be improved to levels equal to or higher than those of existing products, and effects of improving processability and plasticizing efficiency can be expected, and a resin composition including the same.

  本发明涉及一种增塑剂组合物和包括该增塑剂组合物的树脂组合物，可以提供一种增塑剂组合物，其中混合了三种基于对苯二甲酸酯的材料和三种基于环己烷-1,4-二酯的材料，从而可以确保环境友好性，提高机械性能，如抗拉强度和延展率，改善物理性能，如迁移性和挥发损失，使其达到或超过现有产品的水平，并可以期望改善加工性和增塑效率的效果，以及包括该增塑剂组合物的树脂组合物。
• [EN] HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF<br/>[FR] HYDROGENATION D'ACIDES POLYCARBOXYLIQUES DE BENZENE OU DE LEURS DERIVES
  申请人：EXXONMOBIL CHEM PATENTS INC

  公开号：WO2004046078A1

  公开（公告）日：2004-06-03

  A process for hydrogenating benzenepolycarboxylic acids or derivatives thereof, such as esters and/or anhydrides, by bringing one or more benzenepolycarboxylic acids or one or more derivatives thereof into contact with a hydrogen-containing gas in the presence of one or more catalytically active metal, such as platinum, palladium, ruthenium or mixtures thereof, deposited on a catalyst support comprising one or more ordered mesoporous materials.

  一种用于氢化苯基多羧酸或其衍生物（如酯和/或酐）的方法，包括将一个或多个苯基多羧酸或一个或多个其衍生物与含氢气体接触，在一个或多个催化活性金属的存在下进行，这些金属可以是铂、钯、钌或其混合物，它们被沉积在一个催化剂支撑体上，该支撑体包括一个或多个有序介孔材料。
• Production of di-(2-ethylhexyl) terephthalate
  申请人：Cook Leroy Steven

  公开号：US20070038001A1

  公开（公告）日：2007-02-15

  Disclosed is a process for the preparation of di-(2-ethylhexyl) terephthalate by the esterification of terephthalic acid with 2-ethylhexanol at elevated temperature and pressure while the water of reaction is removed from the reaction mixture.

  本发明公开了一种通过在高温高压下，通过酯化反应将对苯二甲酸与2-乙基己醇反应制备出二-(2-乙基己基)苯二甲酸酯的方法，反应过程中除去反应混合物中的反应水。
• [EN] A PLASTICIZER COMPOSITION COMPRISING DI(2-ETHYLHEXYL) TEREPHTHALATE<br/>[FR] COMPOSITION DE PLASTIFIANT COMPRENANT DU TÉRÉPHTALATE DE DI(2-ÉTHYLHEXYLE)
  申请人：BASF SE

  公开号：WO2015126391A1

  公开（公告）日：2015-08-27

  A plasticizer composition is disclosed that includes di(2-ethylhexyl) terephthalate, and which is substantially free of a di-ester according to Formula I: (I), where R1 is a straight-chain or branched alkyl group having from 1 to 13 carbon atoms, and where R1 is different than 2-ethylhexane. The plasticizer composition may be used in a plastisol composition, a powder coating composition, a molding composition, and various other compositions. A method of preparing an aromatic di- ester is also disclosed. The method may prepare the plasticizer composition.

  本发明揭示了一种塑化剂组合物，包括二(2-乙基己基)对苯二甲酸酯，且该组合物基本不含有根据公式I的二酯，其中R1是具有1到13个碳原子的直链或支链烷基，且R1不同于2-乙基己烷。该塑化剂组合物可用于浆料组合物、粉末涂料组合物、模塑组合物和各种其他组合物中。本发明还揭示了一种制备芳香族二酯的方法。该方法可以制备塑化剂组合物。