HOCEt2CH2OMe | 3587-67-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: HOCEt2CH2OMe
• 英文别名: 3-methoxymethyl-pentan-3-ol；3-Hydroxy-3-methoxymethyl-pentan；3-Methoxymethyl-3-hydroxy-pentan；2-Methoxy-3-methyl-pentan-3-ol；Diethyl-methoxymethyl-carbinol；2-Ethyl-1-methoxy-butan-2-ol；3-(Methoxymethyl)pentan-3-ol
• CAS: 3587-67-5
• 化学式: C₇H₁₆O₂
• 分子量: 132.203
• InChiKey: LFEAIYZVEWBDOJ-UHFFFAOYSA-N

物化性质

• 沸点：
  157.7-158.2 °C
• 密度：
  0.9071 g/cm3

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  9
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

安全信息

• 海关编码：
  2909499000

反应信息

• 作为反应物：
  描述：

  HOCEt2CH2OMe 在 磷酸 作用下， 反应 3.0h， 以78%的产率得到2-乙基丁醛
  参考文献：
  名称：

  Duchene, Alain; Mouko-Mpegna, David; Quintard, Jean-Paul, Bulletin de la Societe Chimique de France, 1985, # 5, p. 787 - 793

  摘要：

  DOI：
• 作为产物：
  描述：

  alkaline earth salt of/the/ methylsulfuric acid 在 水 、 镍 作用下， 生成 HOCEt2CH2OMe
  参考文献：
  名称：

  Bernard; Colonge, Bulletin de la Societe Chimique de France, 1945, vol. <5>12, p. 357

  摘要：

  DOI：

文献信息

• CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREFOR
  申请人：Luly Jay R.

  公开号：US20090281081A1

  公开（公告）日：2009-11-12

  Disclosed are novel compounds and a method of treating a disease associated with aberrant leukocyte recruitment and/or activation. The method comprises administering to a subject in need an effective amount of a compound represented by: or physiologically acceptable salt thereof.

  本发明涉及新化合物以及一种治疗与异常白细胞招募和/或激活相关的疾病的方法。该方法包括向需要治疗的受体内给予一种有效量的化合物，该化合物表示为：或其生理上可接受的盐。
• Chemokine receptor antagonists and methods of use therefor
  申请人：Luly R. Jay

  公开号：US20070060592A1

  公开（公告）日：2007-03-15

  Disclosed are novel compounds and a method of treating a disease associated with aberrant leukocyte recruitment and/or activation. The method comprises administering to a subject in need an effective amount of a compound represented by: or physiologically acceptable salt thereof.

  本发明涉及一种新型化合物和一种治疗与异常白细胞招募和/或激活相关的疾病的方法。该方法包括向需要治疗的受体内投与有效量的化合物，所述化合物的表示式为：或其生理上可接受的盐。
• METHOD FOR PREPARING ORGANIC FLUORIDE-ALIPHATIC COMPOUND AND METHOD FOR PURIFYING ORGANIC FLUORIDE-ALIPHATIC COMPOUND
  申请人：The Asan Foundation

  公开号：EP3216780A1

  公开（公告）日：2017-09-13

  The present disclosure relates to a method for preparing a radiopharmaceutical and, specifically, to a method for preparing an organic fluoride-aliphatic compound usable as a radiopharmaceutical, to a method for purifying the prepared organic fluoride-aliphatic compound, and to a method for preparing a radiopharmaceutical by using a cassette comprising a backdraft preventing reaction container. According to the present disclosure, the organic fluoride-aliphatic compound can be prepared and purified through even a simple process at high yield, high efficiency, and high purity, and the radiopharmaceutical can be safely prepared without damage to a synthetic apparatus.

  本公开涉及一种制备放射性药物的方法，具体而言，涉及一种制备可用作放射性药物的有机氟脂肪族化合物的方法，涉及一种纯化所制备的有机氟脂肪族化合物的方法，还涉及一种通过使用由防逆流反应容器组成的盒制备放射性药物的方法。根据本公开内容，即使是简单的工艺，也可以高产率、高效率和高纯度地制备和纯化有机氟脂化合物，并且可以安全地制备放射性药物，而不会损坏合成装置。
• Schoellkopf,U. et al., Justus Liebigs Annalen der Chemie, 1967, vol. 704, p. 120 - 125
  作者：Schoellkopf,U. et al.

  DOI：——

  日期：——
• Bifunctional even-electron ions: 1—Fragmentation behaviour of ω-methoxy-, ω-hydroxy- and ω-chloro-oxonium ions
  作者：U. I. Záhorszky

  DOI：10.1002/oms.1210201008

  日期：1985.10

  AbstractBifunctional oxonium ions—generated from tertiary aliphatic alcohols containing an additional hydroxy, methoxy or chloro group at the end of an alkyl side‐chain—do not markedly exhibit fragmentations typical of ordinary oxonium ions, but show as the main reactions those caused by functional group interaction, through‐space interaction being the dominant factor. The main primary fragmentation is loss of the additional functional group X as HX, followed by loss of the side‐chain originally separating the two functional groups, leading to carbonyl cations. This typical reaction sequence is initiated by proton migration from the oxonium moiety to the additional functional group. The reaction behaviour of the bifunctional ions is discussed. The lowest homologues show specific deviations from the general fragmentation behaviour.