n-decyl methylphosphonic acid | 1832-61-7

• 分子结构分类: 有机化合物 - 有机酸及其衍生物
• 英文名称: n-decyl methylphosphonic acid
• 英文别名: decyl methylphosphonic acid；Methylphosphonsaeure-monodecylester；Decoxy(methyl)phosphinic acid
• CAS: 1832-61-7
• 化学式: C₁₁H₂₅O₃P
• 分子量: 236.291
• InChiKey: NEUBVQHITAHGKW-UHFFFAOYSA-N

物化性质

• 熔点：
  38-39 °C
• 沸点：
  323.1±25.0 °C(Predicted)
• 密度：
  0.992±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  15
• 可旋转键数：
  10
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  n-decyl methylphosphonic acid 在 palladium dihydroxide 氢气 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  Synthesis of novel glycosyl phosphate analogues: Derivatives of an acceptor substrate for the Leishmania elongating α-d-mannopyranosylphosphate transferase

  摘要：

  The three structural analogues of dec-9-enyl beta-D-galactosyl-(1-->4)-alpha-D-mannosyl phosphate, comprising thiophosphate, boranophosphate and methylphosphonate derivatives, were prepared via disaccharide H-phosphonate or trichloroacetimidate (for the methylphosphonate synthesis) intermediates. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(99)01381-7
• 作为产物：
  描述：

  癸醇 、 甲基膦酸 在 苯胂酸 作用下， 以 甲苯 为溶剂， 反应 28.0h， 生成 n-decyl methylphosphonic acid
  参考文献：
  名称：

  PREPARATION, DERIVATIZATION WITH TRIMETHYLSILYLDIAZOMETHANE, AND GC/MS ANALYSIS OF A “POOL” OF ALKYL METHYLPHOSPHONIC ACIDS FOR USE AS QUALITATIVE STANDARDS IN SUPPORT OF COUNTERTERRORISM AND THE CHEMICAL WEAPONS CONVENTION

  摘要：

  There are hundreds of nerve agents in the class of alkyl methylphosphonofluoridates covered by Schedule 1 of the CWC (Chemical Weapons Convention). Hydrolysis of these sarin-like nerve agents results in all equal number of alkyl methylphosphonic acids. These allkyl methylphosphonic acids are persistent and provide good evidence of specific agent production or use. In order to support the CWC and counterterrorism activities, it is desirable to have ready access to each of these hydrolysis products for use as qualitative standards. A means for simultaneously producing multiple alkyl methylphosphonates from methylphosphonic acid and the corresponding alcohols was developed. Derivatization of these alkyl methylphosphonic acids with trimethylsilyldiazomethane yields the corresponding methyl esters which are suitable for GC/MS analysis.

  DOI：

  10.1080/10426500490459632

文献信息

• Petrov,K.A. et al., Journal of general chemistry of the USSR, 1965, vol. 35, p. 723 - 726
  作者：Petrov,K.A. et al.

  DOI：——

  日期：——