diethylammonium diethylphosphate | 5802-75-5

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机磷酸及其衍生物
• 英文名称: diethylammonium diethylphosphate
• 英文别名: Diethylazanium;diethyl phosphate
• CAS: 5802-75-5
• 化学式: C₄H₁₁N*C₄H₁₁O₄P
• 分子量: 227.241
• InChiKey: UOCJLHJBUVWLSQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.78
• 重原子数：
  14
• 可旋转键数：
  6
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  67.8
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  diethylammonium diethylphosphate 、 重氮乙烷 生成 磷酸三乙酯
  参考文献：
  名称：

  STANKOV, I. I.;BERESNEV, A. N.;LANIN, S. N., ZH. ANAL. XIMII, 46,(1991) N, S. 943-950

  摘要：

  DOI：
• 作为产物：
  描述：

  磷酸二乙酯 、 二乙胺 生成 diethylammonium diethylphosphate
  参考文献：
  名称：

  STANKOV, I. I.;BERESNEV, A. N.;LANIN, S. N., ZH. ANAL. XIMII, 46,(1991) N, S. 943-950

  摘要：

  DOI：

文献信息

• Synthesis, characterization, computational and cytotoxic evaluation of novel [N, N-dialkyl ammonium] [diphenyl/ethyl phosphoryl oxides]
  作者：Muzzaffar A. Bhat、Salman Jameel、Masrat Jan、Manzoor A. Rather、Sheeraz A. Bhat、Raymond J. Butcher、Sanjay K. Srivastava

  DOI：10.1016/j.molstruc.2019.02.096

  日期：2019.6

  N-dialkyldithiocarbamate on reaction with diphenyl and diethyl phosphoryl chloride resulted into a unique metal ion catalyzed hydrolysis of di-phenyl/ethyl phosphoryl N,N-dialkyl dithiocarbamate to afford a novel [N,N-dialkyl ammonium][diphenyl phosphoryl oxide] (1/1՛ and 3) and [N,N-dialkyl ammonium] [diethyl phosphoryl oxide] (2/2՛ and 4). The resulting phosphoryl oxides were characterized using NMR, IR and Mass

  摘要 N,N-二烷基二硫代氨基甲酸酯的银盐和二乙基磷酰氯与二苯基和二乙基磷酰氯反应生成独特的金属离子催化水解二苯基/乙基磷酰N,N-二烷基二硫代氨基甲酸酯，得到新型[N,N-二烷基铵][二苯基磷酰氧]（1/1翻和3）和[N,N-二烷基铵][二乙基磷酰氧]（2/2翻和4）。使用NMR、IR和质谱数据分析表征所得磷酰氧化物。代表性化合物 1/1͛ 的单晶 X 射线证实了在正交 Pna21 空间群中结晶的指定结构。将该化合物的实验获得的参数与理论计算的参数进行比较。所有化合物 1、2、图 3 和 4 使用密度泛函理论与采用基组组合 6-31G (d, p) 的混合泛函 B3LYP 进行了优化。确定了所有化合物的分子静电势表面分析以及与观察到的反应性相容的 FMO 分析。体外细胞毒性显示出广泛的细胞毒性作用谱，化合物 4 显示出最高但较弱的细胞毒性潜力，其 IC50 为 14、28、25、18 和
• JP5647820
  申请人：——

  公开号：——

  公开（公告）日：——
• Quin, Louis D.; Bourdieu, Catherine; Quin, Gyoengyi S., Phosphorus, Sulfur and Silicon and the Related Elements, 1991, vol. 63, # 3/4, p. 349 - 362
  作者：Quin, Louis D.、Bourdieu, Catherine、Quin, Gyoengyi S.

  DOI：——

  日期：——
• METHOD FOR STABILIZING LIPF6, ELECTROLYTE SOLUTION FOR NONAQUEOUS SECONDARY BATTERIES HAVING EXCELLENT THERMAL STABILITY, AND NONAQUEOUS SECONDARY BATTERY HAVING EXCELLENT THERMAL STABILITY
  申请人：TOSOH F-TECH, INC.

  公开号：US20150140445A1

  公开（公告）日：2015-05-21

  [Problem] To provide: a method for stabilizing a solution that contains LiPF 6 by increasing thermal stability of LiPF 6 without changing the structure thereof; an electrolyte solution for nonaqueous secondary batteries, which has increased thermal stability; and a nonaqueous secondary battery which has increased thermal stability. [Solution] To have a solution containing LiPF 6 contain a phosphoric acid ester amide represented by general formula (I) in such an amount that the molar ratio of the phosphoric acid ester amide relative to LiPF 6 is 0.001-2. (In the formula, m represents an integer of 1 or 2; each of R 1 and R 2 represents a branched or linear alkyl group having 1 to 6 carbon atoms and/or a hydrocarbon group having an unsaturated bond, provided that R 1 and R 2 may have a substituent that is selected from the group consisting of an alkoxy group, an amino group, an alkylthio group, a saturated heterocyclic group, an unsaturated heterocyclic group, and a fluorine atom, and R 1 and R 2 may combine together to form a 5 to 8 membered cyclic structure; and R 3 represents a branched or linear alkyl group having 1 to 6 carbon atoms or a branched or linear fluorine-containing alkyl group having 1 to 6 carbon atoms)
• US9472829B2
  申请人：——

  公开号：US9472829B2

  公开（公告）日：2016-10-18