3,5-di(tert-butyl)-4-hydroxybenzoic ethyl acid imino ester hydrochloride | 84654-55-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 3,5-di(tert-butyl)-4-hydroxybenzoic ethyl acid imino ester hydrochloride
• 英文别名: Hydrochloride of ethyl iminoester of 4-hydroxy-3,5-di-tert-butylbenzoic Acid
• CAS: 84654-55-7
• 化学式: C₁₇H₂₇NO₂*ClH
• 分子量: 313.868
• InChiKey: QZMQAKZHMVTCKM-UHFFFAOYSA-N

物化性质

• 熔点：
  258.5-260 °C (decomp)

计算性质

• 辛醇/水分配系数(LogP)：
  4.77
• 重原子数：
  21.0
• 可旋转键数：
  2.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  53.31
• 氢给体数：
  2.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  3,5-di(tert-butyl)-4-hydroxybenzoic ethyl acid imino ester hydrochloride 以80%的产率得到
  参考文献：
  名称：

  KELAREV, V. I.;SHVEXGEJMER, S. G.;KOSHELEV, V. N.;LUNIN, A. F.;SHVEXGEJME+, ZH. BCEC. XIM. O-BA, 1982, 27, N 5, 582-584

  摘要：

  DOI：
• 作为产物：
  描述：

  3,5-二叔丁基-4-羟基苯甲腈 、 盐酸 以58%的产率得到
  参考文献：
  名称：

  KELAREV, V. I.;SHVEXGEJMER, S. G.;KOSHELEV, V. N.;LUNIN, A. F.;SHVEXGEJME+, ZH. BCEC. XIM. O-BA, 1982, 27, N 5, 582-584

  摘要：

  DOI：

文献信息

• Synthesis of new types of aminomethylenediphosphorus-containing acids and their derivatives
  作者：A. A. Prishchenko、M. V. Livantsov、O. P. Novikova、L. I. Livantsova、I. S. Ershov、V. S. Petrosyan

  DOI：10.1134/s1070363215020048

  日期：2015.2

  Convenient methods for synthesis of various aminomethylenediphosphorus-containing acids and their derivatives starting from available trimethylsilyl esters of hypophosphorous and phosphorous acids, ethoxymethyleneimine hydrochlorides, and N-substituted formamides have been proposed. Selected properties of the obtained compounds have been examined.
• Synthesis and properties of sym-triazine derivatives. 6. Synthesis of 2-amino- and 2,4-diamino-sym-triazines containing sterically hindered phenol segments
  作者：V. I. Kelarev、F. Laauad Yakh'ya、R. A. Karakhanov、A. F. Lunin、V. A. Vinokurov

  DOI：10.1007/bf00476544

  日期：1987.10
• Synthesis and properties of symm-triazine derivatives. 4. Synthesis of 2,4,6-trisubstituted symm-triazines containing sterically-hindered phenol fragments
  作者：V. I. Kelarev、F. Laawad Yakhya、R. A. Karakhanov、A. F. Lunin、O. V. Malova

  DOI：10.1007/bf00515432

  日期：1986.1
• Synthesis of 2,5-disubstituted 1,3,4-oxadiazoles containing a sterically hindered 4-hydroxy-3,5-di(tert-butyl)phenyl group
  作者：V. I. Kelarev、V. N. Koshelev、M. A. Silin

  DOI：10.1007/bf02291806

  日期：1997.6
• Synthesis of the New Types of<i>N</i>-Unsubstituted Aminomethylenebisorganophosphorus Acids and Their Derivatives
  作者：Andrey A. Prishchenko、Mikhail V. Livantsov、Olga P. Novikova、Ludmila I. Livantsova、Ivan S. Ershov、Valery S. Petrosyan

  DOI：10.1002/hc.21220

  日期：2015.1

  ABSTRACTThe interaction of trimethylsilyl esters of trivalent organophosphorus acids containing PH and POSiMe3 groups with hydrochlorides of ethoxymethylene imines is a convenient method for the synthesis of new trimethylsilyl esters of N‐unsubstituted aminomethylenebisorganophosphorus acids with three and four coordinated phosphorus. Also trimethylsilyl trifluoromethanesulfonate as effective catalyst is used for the similar interaction of hydrochlorides of ethoxymethylene imines with tris(trimethylsilyl)phosphite. The corresponding bisorganophosphorus acids and their derivatives are presented.