t-butyl 3-propanoate | 150257-69-5

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: t-butyl 3-propanoate
• 英文别名: tert-butyl 3-[[chloro(ethoxy)phosphinothioyl]amino]propanoate
• CAS: 150257-69-5
• 化学式: C₉H₁₉ClNO₃PS
• 分子量: 287.748
• InChiKey: SQSNQXNQGYUNAB-UHFFFAOYSA-N

物化性质

• 沸点：
  334.8±44.0 °C(Predicted)
• 密度：
  1.202±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.81
• 重原子数：
  16.0
• 可旋转键数：
  6.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.89
• 拓扑面积：
  47.56
• 氢给体数：
  1.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  t-butyl 3-propanoate 在 三氟乙酸 作用下， 以 乙腈 为溶剂， 反应 1.0h， 生成 O-ethyl O-(3,5,6-trichloro-2-pyridyl) N-(2-carboxyethyl)-phosphoramidothioate
  参考文献：
  名称：

  McAdam, David P.; Skerritt, John H., Australian Journal of Chemistry, 1993, vol. 46, # 7, p. 959 - 967

  摘要：

  DOI：
• 作为产物：
  描述：

  N-Cbz-beta-丙氨酸叔丁酯 在 palladium on activated charcoal 氢气 、 三乙胺 作用下， 以 乙腈 为溶剂， 生成 t-butyl 3-propanoate
  参考文献：
  名称：

  McAdam, David P.; Skerritt, John H., Australian Journal of Chemistry, 1993, vol. 46, # 7, p. 959 - 967

  摘要：

  DOI：

文献信息

• Development of Enzyme-Linked Immunosorbent Assays for the Insecticide Chlorpyrifos. 1. Monoclonal Antibody Production and Immunoassay Design
  作者：Juan J. Manclús、Jaime Primo、Angel Montoya

  DOI：10.1021/jf960144q

  日期：1996.1.1

  The present work describes the production and characterization of monoclonal antibodies (MAbs) to the insecticide chlorpyrifos and their incorporation into several ELISA configurations. With this aim, a collection of chlorpyrifos haptens was synthesized by introducing appropriate spacers in opposite sites of the analyte molecular structure. From mice immunized with protein conjugates of these haptens, several hybridomas secreting MAbs with the ability to sensitively bind the analyte were obtained. IMAbs showing the highest affinity to chlorpyrifos in homologous assays (I-50 values in the 20-220 nM range) were selected. Hapten heterology involving modifications of the moiety closer to the attachment site provided the highest improvement in sensitivity. MAbs displayed striking differences in their cross-reactivity pattern with structurally related compounds. One MAb (I-50 around 10 nM) was incorporated into other ELISA formats. No remarkable changes of assay characteristics, other than immunoreagent consumption and immunoassay procedure, were found. These ELISAs are potentially very valuable analytical tools for the rapid and sensitive determination of this insecticide.