N,N-dimethylethanolamine(0-4-methoxybenzyl)ether | 1679-66-9

• 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: N,N-dimethylethanolamine(0-4-methoxybenzyl)ether
• 英文别名: N,N-dimethylethanolamine(O-4-methoxybenzyl)ether；2-[(4-methoxyphenyl)methoxy]-N,N-dimethylethanamine
• CAS: 1679-66-9
• 化学式: C₁₂H₁₉NO₂
• 分子量: 209.288
• InChiKey: HKAXFESAPCPDJX-UHFFFAOYSA-N

物化性质

• 沸点：
  118-121 °C(Press: 1 Torr)
• 密度：
  1.0421 g/cm3

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  15
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  21.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  N,N-二甲基乙醇胺 、 4-甲氧基氯苄 在 sodium hydride 、 水 、 sodium hydroxide 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 60.67h， 以28%的产率得到N,N-dimethylethanolamine(0-4-methoxybenzyl)ether
  参考文献：
  名称：

  [EN] NOVEL PRECURSORS OF RADIOLABELLED CHOLINE ANALOG COMPOUNDS
  [FR] NOUVEAU PRÉCUSEUR

  摘要：

  公开号：

  WO2012040133A3

文献信息

• [EN] ISOTOPIC CARBON CHOLINE ANALOGS<br/>[FR] ANALOGUES DE LA CHOLINE MARQUÉS PAR UN ISOTOPE DU CARBONE
  申请人：GE HEALTHCARE LTD

  公开号：WO2012040151A3

  公开（公告）日：2012-05-03
• [EN] CHOLINE ANALOGS AS RADIOTRACER<br/>[FR] NOUVEAU RADIOTRACEUR
  申请人：GE HEALTHCARE LTD

  公开号：WO2012040138A3

  公开（公告）日：2012-05-18
• NOVEL PRECURSOR OF RADIOLABELLED CHOLINE ANALOG COMPOUNDS
  申请人：Aboagye Eric Ofori

  公开号：US20130178653A1

  公开（公告）日：2013-07-11

  The present invention describes intermediate(s), pre-cursor(s), for the preparation of radialabelled choline analogs to be used as radiotracers for Positron Emission Tomography (PET) or Single Photon Emission Computed Tomography (SPECT) imaging of diseases.
• NOVEL RADIOTRACER
  申请人：Aboagye Eric Ofori

  公开号：US20130202530A1

  公开（公告）日：2013-08-08

  Novel radiotracer(s) for Positron Emission Tomography (PET) or Single Photon Emission Computed Tomography (SPECT) imaging of disease states related to altered choline metabolism (e.g., tumor imaging of prostate, breast, brain, esophageal, ovarian, endometrial, lung and prostate cancer—primary tumor, nodal disease or metastases). The present invention also describes intermediate(s), pre-cursor(s), pharmaceutical composition(s), methods of making, and methods of use of the novel radiotracer(s).
• ISOTOPIC CARBON CHOLINE ANALOGS
  申请人：Aboagye Eric Ofori

  公开号：US20130183239A1

  公开（公告）日：2013-07-18

  Novel choline-derived radiotracer (s) having an isotopic carbon for Positron Emission Tomography (PET) or Single Photon Emission Computed Tomography (SPECT) imaging of disease states related to altered choline metabolism (e.g., tumor imaging of prostate, breast, brain, esophageal, ovarian, endometrial, lung and prostate cancer—primary tumor, nodal disease or metastases).