N-丁基丁烷-1-胺(二丁基氨基)二硫代甲酸盐 | 2391-80-2

• 物质功能分类: 有机原料 - 羧酸类化合物及衍生物
• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: N-丁基丁烷-1-胺(二丁基氨基)二硫代甲酸盐
• 中文别名: 甲基2-(4-硝基苯基)丁酸酯
• 英文名称: di-n-butylammonium di-n-butyldithiocarbamate
• 英文别名: Dibutylammonium-dibutyldithiocarbamate；dibutylazanium;N,N-dibutylcarbamodithioate
• CAS: 2391-80-2
• 化学式: C₈H₂₀N*C₉H₁₈NS₂
• 分子量: 334.634
• InChiKey: YPQOCKOIFRNBQW-UHFFFAOYSA-N

物化性质

• 物理描述：
  Liquid

计算性质

• 辛醇/水分配系数(LogP)：
  5.28
• 重原子数：
  21
• 可旋转键数：
  12
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.94
• 拓扑面积：
  48.4
• 氢给体数：
  2
• 氢受体数：
  3

安全信息

• 海关编码：
  2930909090

反应信息

• 作为反应物：
  描述：

  indium 、 N-丁基丁烷-1-胺(二丁基氨基)二硫代甲酸盐 在 sodium hydroxide 作用下， 以 盐酸 、 丙酮 为溶剂， 以78.6%的产率得到indium(III) di-n-butyldithiocarbamate
  参考文献：
  名称：

  Thermochemical parameters of dialkyldithiocarbamate chelates of indium(III)

  摘要：

  A series of dialkyldithiocarbamate chelates of indium(III) of the general formula In(S2CNR2)(3), (R = C2H5, n-C3H7, i-C3H7, n-C4H9 and i-C4H9), were prepared from the reaction of hydrochloric acid solution of metallic indium and the corresponding dialkylammonium salt of the ligand at pH = 3-4, giving yields better than 78%. The standard molar enthalpies of formation of crystalline dialkyldithiocarbamate chelates of In(III), were determined through reaction-solution calorimetry in acetone, at 298.15 K. The corresponding standard molar enthalpies of sublimation were estimated by means of differential scanning calorimetry. By combining of the values from these enthalpies, the standard molar enthalpies of formation in the gas were obtained. From the standard molar enthalpies of formation of the gaseous chelates the homolytic 191.9 +/- 3.6, 167.9 +/- 3.1, 136.4 +/- 2.5, 174.3 +/- 3.0 and 189.1 +/- 3.9 kJ mol(-1), and heterolytic 938.1 +/- 3.6, 961.9 +/- 3.1, 993.5 +/- 2.7, 1003.0 +/- 3.0 and 1047.3 +/- 3.9 kJ mol(-1), mean indium-sulphur bond-dissociation enthalpies were calculated. (C) 2000 Elsevier Science B.V. All rights reserved.

  DOI：

  10.1016/s0040-6031(99)00322-6
• 作为产物：
  描述：

  二硫化碳 、 二正丁胺 以 丙酮 为溶剂， 以83%的产率得到N-丁基丁烷-1-胺(二丁基氨基)二硫代甲酸盐
  参考文献：
  名称：

  二正丁基二硫代氨基甲酸酯与磷族元素螯合物的热化学性质

  摘要：

  摘要 通过溶液反应量热法在 298.15 K 下测定的结晶三（二正丁基二硫代氨基甲酸）e (III) (e = P、As、Sb 或 Bi) 的标准摩尔形成焓为 -(705.5 ± 7.3)、-(443.1±5.4)、-(526.2±2.5)和-(530.7±5.5)kJ·mol -1 分别。升华焓：(136±3)、(128±3)、(179±3)和(202±3)kJ·mol -1 被估计。从气体复合物的形成焓，计算均溶和溶血以及异溶平均标准摩尔元素-硫键焓。这些值与元素-硫键距离相关，较大的磷-硫键焓反映了键合形成中 d 轨道的更好重叠。

  DOI：

  10.1016/0021-9614(89)90018-9

文献信息

• Kinetic study of the thermal decomposition on bis(dialkyldithiocarbamate) Cd(II) complexes by isothermal and non-isothermal thermogravimetry
  作者：Maria C. Nobrega Machado、Liliane Magalhães Nunes、Carlos Davidson Pinheiro、José Caetano Machado、Antonio Gouveia Souza

  DOI：10.1016/s0040-6031(98)00643-1

  日期：1999.3

  Abstract The thermal decomposition kinetics of solid Cd(S 2 CNR 2 ) 2 complexes, where R=C 2 H 5 , n -C 3 H 7 , n -C 4 H 9 and iso-C 4 H 9 , has been studied using isothermal and non-isothermal thermogravimetry. Superimposed TG/DTG/DSC curves show that thermal decomposition reactions occur in the liquid phase. The kinetic model that best adjusted the experimental isothermal TG data was the one-dimensional

  摘要 研究了固体 Cd(S 2 CNR 2 ) 2 配合物的热分解动力学，其中 R=C 2 H 5 、n -C 3 H 7 、n -C 4 H 9 和iso-C 4 H 9 ，已使用等温和非等温热重法。叠加的 TG/DTG/DSC 曲线表明热分解反应发生在液相中。最佳调整实验等温TG数据的动力学模型是一维相界反应控制过程R 1 。热分析数据表明热稳定性序列 Cd(S 2 CNBu n 2 ) 2 >Cd(S 2 CNPr n 2 ) 2 >Cd(S 2 CNBu i 2 ) 2 >Cd(S 2 CNEt 2 ) 2 ，根据表观活化能的稳定性顺序。
• Utilization of carbon disulfide as a powerful building block for the synthesis of 2-aminobenzoxazoles
  作者：Tirumaleswararao Guntreddi、Bharat Kumar Allam、Krishna Nand Singh

  DOI：10.1039/c3ra41189c

  日期：——

  This protocol describes a novel, mild and convenient route to afford 2-aminobenzoxazoles in high yields, and represents a significant advance towards an environmentally friendly strategy. Aliphatic amines are made to react with carbon disulfide to provide intermediate dithiocarbamates (DTC), which in the presence of 2-aminophenol, subsequently undergo successive intermolecular nucleophilic attack and desulfurization to produce 2-aminobenzoxazoles within 3 h.

  此协议描述了一条新颖、温和且便捷的途径，能够在高产率下制备2-氨基苯并噁唑，标志着向环境友好型策略迈出了重要的一步。脂肪族胺与二硫化碳反应生成中间体二硫代氨基甲酸盐（DTC），在2-氨基苯酚的存在下，这些中间体随后经历连续的分子间亲核攻击和脱硫反应，在3小时内即可生成2-氨基苯并噁唑。
• Cu-mediated one-pot three-component synthesis of 3-N-substituted 1,4,2-benzodithiazine 1,1-dioxide derivatives
  作者：Wei Dong、Zemei Ge、Xin Wang、Ridong Li、Runtao Li

  DOI：10.1016/j.tet.2020.131354

  日期：2020.7

  A novel and efficient copper-catalyzed one-pot procedure for the synthesis of 3-N-substituted 1,4,2-benzodithiazine 1,1-dioxide derivatives from 2-halobenzenesulfonamides, amines and CS2 is described. The reaction proceeds through Ullmann-type S-arylation, intramolecular addition of NH2 with CS and dehydrosulfide, which provides a new and useful strategy for construction of cyclic aromatic sulfonamides

  描述了一种新颖且有效的铜催化一锅法，用于从2-卤代苯磺酰胺，胺和CS 2合成3-N-取代的1,4,2-苯并噻二嗪1,1-二氧化物衍生物。该反应通过乌尔曼型S-芳基化，NH 2与C S和脱氢硫化物的分子内加成进行，这为构建环状芳族磺酰胺提供了新的有用的策略。
• METHOD FOR PRODUCING ARYL, HETEROARYL, OR ALKENYL-SUBSTITUTED UNSATURATED HYDROCARBON
  申请人：Nishizawa Toshiaki

  公开号：US20120142975A1

  公开（公告）日：2012-06-07

  The present invention relates to a method for producing aryl-, heteroaryl- or alkenyl-substituted unsaturated hydrocarbons, containing: reacting aryl halides, heteroaryl halides or alkenyl halides with alkynes or alkenes in the presence of a palladium catalyst to obtain a crude product, and subsequently distillatively purifying the crude product in the presence of a compound having at least one NC═S group.

  本发明涉及一种生产含芳基、杂芳基或烯基取代的不饱和烃的方法，包括：在钯催化剂存在下，将芳基卤化物、杂芳基卤化物或烯基卤化物与炔烃或烯烃反应，以获得粗产品，随后在至少含有一个NC═S基团的化合物存在下，对粗产品进行蒸馏纯化。
• Enthalpies of formation of crystalline dialkylammoniumdialkyldithiocarbamates: alkyl = ethyl, n-propyl, i-propyl, n-butyl, and i-butyl
  作者：Manuel A.V Ribeiro Da Silva、Ana M.V Reis、Geoffrey Pilcher

  DOI：10.1016/0021-9614(87)90030-9

  日期：1987.8

  The standard (po = 101.325 kPa) molar enthalpies of formation of some crystalline dialkylammoniumdialkyldithiocarbamates were determined at 298.15 K by both solution-reaction calorimetry and by rotating-bomb calorimetry. The values from the two methods agreed to within the limits of experimental error, giving the weighted mean values: R ΔfHmo(R2NH2S2CNR2, cr)/(kJ·mol−1) Ethyl −249.2±2.2 n-Propyl −353

  一些结晶二烷基二烷基二硫代氨基甲酸铵的标准 (po = 101.325 kPa) 摩尔形成焓是在 298.15 K 下通过溶液反应量热法和旋转弹量热法测定的。两种方法的值在实验误差范围内一致，给出加权平均值： R ΔfHmo(R2NH2S2CNR2, cr)/(kJ·mol−1) 乙基 -249.2±2.2 正丙基 -353.2±1.3 i-丙基 -349.6±1.3 正丁基 -461.3±1.6 异丁基 -463.8±1.4