3-methoxy-3-phenylpropan-1-ol | 18838-00-1

• 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-methoxy-3-phenylpropan-1-ol
• CAS: 18838-00-1
• 化学式: C₁₀H₁₄O₂
• 分子量: 166.22
• InChiKey: JEZYKPSREKPMLJ-UHFFFAOYSA-N

物化性质

• 沸点：
  280.9±20.0 °C(predicted)
• 密度：
  1.039±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  12
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  3-methoxy-3-phenylpropan-1-ol 在 正丁基锂 作用下， 反应 1.25h， 生成 环丙基苯
  参考文献：
  名称：

  Brookhart, Maurice; Liu, Yumin, Journal of the American Chemical Society, 1991, vol. 113, # 3, p. 939 - 944

  摘要：

  DOI：
• 作为产物：
  描述：

  methyl β-phenyl-β-methoxy-propionate 在 lithium aluminium tetrahydride 、 乙醚 作用下， 生成 3-methoxy-3-phenylpropan-1-ol
  参考文献：
  名称：

  Novak; Protiva, Collection of Czechoslovak Chemical Communications, 1958, vol. 23, p. 663,666, 671

  摘要：

  DOI：

文献信息

• 4,5-DIHYDRO-OXAZOL-2YL DERIVATIVES
  申请人：Galley Guido

  公开号：US20100029589A1

  公开（公告）日：2010-02-04

  The invention relates to compounds of formula I wherein R 1 , R 2 , X, Y, and n are defined in the specification and to pharmaceutically acceptable acid addition salts thereof. The invention also provides pharmaceutical compositions and methods of manufacture of such compounds. The compounds are useful for the treatment of diseases related to the biological function of the trace amine associated receptors, which diseases are depression, anxiety disorders, bipolar disorder, attention deficit hyperactivity disorder, stress-related disorders, psychotic disorders, schizophrenia, neurological diseases, Parkinson's disease, neurodegenerative disorders, Alzheimer's disease, epilepsy, migraine, substance abuse and metabolic disorders, eating disorders, diabetes, diabetic complications, obesity, dyslipidemia, disorders of energy consumption and assimilation, disorders and malfunction of body temperature homeostasis, disorders of sleep and circadian rhythm, and cardiovascular disorders.

  该发明涉及公式I的化合物，其中R1、R2、X、Y和n在规范中定义，并且其药学上可接受的酸盐。该发明还提供了制备这种化合物的药物组合物和方法。这些化合物可用于治疗与痕量胺相关受体的生物功能相关的疾病，这些疾病包括抑郁症、焦虑症、躁郁症、注意缺陷多动障碍、与压力有关的疾病、精神疾病、精神分裂症、神经系统疾病、帕金森病、神经退行性疾病、阿尔茨海默病、癫痫、偏头痛、物质滥用和代谢紊乱、进食障碍、糖尿病、糖尿病并发症、肥胖症、脂质代谢异常、能量消耗和吸收异常、体温稳态异常、睡眠和昼夜节律异常、心血管疾病。
• Single and double reductive cleavage of CO bonds of aromatic dimethyl acetals and ketals: Generation of benzylic mono- and dicarbanions
  作者：Ugo Azzena、Giovanni Melloni、Luisa Pisano、Barbara Sechi

  DOI：10.1016/s0040-4039(00)73488-5

  日期：1994.9

  The reductive cleavage of aromatic dimethyl acetals and ketals, 1, with Li metal in THF at low temperature allows the generation of stable α-alkoxy-α-arylsubstituted carbanions, avoiding the Wittig rearrangement. Reaction of these carbanions with various electrophiles afforded the expected products 2. Further in situ reaction of compounds 2 afforded the products of reductive electrophilic disubstitution

  在低温下用四氢呋喃中的锂金属对芳族二甲基乙缩醛和缩酮1进行还原性裂解，可生成稳定的α-烷氧基-α-芳基取代的碳负离子，从而避免了Wittig重排。这些碳负离子与各种亲电试剂的反应提供了预期的产物2。进一步原位化合物的反应2得到的还原电双取代，的产品3。
• Asymmetric Synthesis in the Methoxy-mercuration of α, β-Unsaturated Esters
  作者：Junichi Oda、Tsutomu Nakagawa、Yuzo Inouye

  DOI：10.1246/bcsj.40.373

  日期：1967.2

  The methoxy-mercuration of (−)-menthyl crotonate, cinnamate, and β-methylcinnamate resulted in partial asymmetric syntheses of the corresponding β-methoxylated derivatives, (−)-R-β-methoxybutyric acid, (−)-S-β-methoxy-β-phenylpropyl alcohol, and (−)-S-β-methoxy-β-phenylbutyl alcohol. The results suggested an ionic mechanism involving a cyclic mercurinium ion as an intermediate, formed by the electrophilic

  (-)-巴豆酸薄荷酯、肉桂酸和β-肉桂酸甲酯的甲氧基汞化导致相应的β-甲氧基化衍生物、(-)-R-β-甲氧基丁酸、(-)-S-β-的部分不对称合成甲氧基-β-苯丙醇和(-)-S-β-甲氧基-β-苯丁醇。结果表明，一种离子机制涉及环状汞离子作为中间体，由醋酸汞从系统的 Cram-Prelog 模型中双键的受阻最小侧的亲电攻击形成，然后是甲氧基的攻击来自相反侧的阴离子。讨论了导致主要对映体的反应机理。
• Bis(2-ethylhexyl)amine as an Effective Organocatalyst for the Racemic Reactions of α,β-Unsaturated Aldehydes Involving an Iminium Ion
  作者：Yujiro Hayashi、Xiaolei Han、Naoki Mori

  DOI：10.1055/a-2179-5916

  日期：2023.12

  Bis(2-ethylhexyl)amine is shown to be a suitable organocatalyst to prepare racemic compounds in the reactions of α,β-unsaturated aldehydes involving an iminium ion, whereas diphenylprolinol silyl ether is a well-known chiral organocatalyst for the asymmetric versions of the same reactions. The generality and limitations of bis(2-ethylhexyl)amine are disclosed.

  双（2-乙基己基）胺被证明是一种适合在涉及亚胺离子的 α,β-不饱和醛反应中制备外消旋化合物的有机催化剂，而二苯基脯氨醇甲硅烷基醚是一种众所周知的手性有机催化剂，用于不对称形式的同样的反应。公开了双(2-乙基己基)胺的一般性和局限性。
• Kiladze, T. K.; Mel'nitskii, I. A.; Glukhova, O. F., Doklady Chemistry, 1987, vol. 293, p. 188 - 192
  作者：Kiladze, T. K.、Mel'nitskii, I. A.、Glukhova, O. F.、Kantor, E. A.、Rakhmankulov, D. L.、Paushkin, Ya. M.

  DOI：——

  日期：——