3,3-dimethyl-4-oxo-4-phenylbutanoic acid | 73593-66-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 3,3-dimethyl-4-oxo-4-phenylbutanoic acid
• 英文别名: 3-Methyl-3-benzoyl-buttersaeure；3,3-dimethyl-4-oxo-4-phenyl-butyric acid；3,3-Dimethyl-4-oxo-4-phenyl-buttersaeure；γ-Oxo-β.β-dimethyl-γ-phenyl-buttersaeure；γ-Oxo-β.β-dimethyl-γ-phenyl-propan-α-carbonsaeure；β-Methyl-β-benzoyl-buttersaeure；β-Benzoyl-isovaleriansaeure；3,3-Dimethyl-4-oxo-4-phenylbutyric acid
• CAS: 73593-66-5
• 化学式: C₁₂H₁₄O₃
• 分子量: 206.241
• InChiKey: YBTFNPBJKLKDLA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  54.4
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2,2-dimethyl-1-phenyl-4-pentene 在 铬酸 、 溶剂黄146 作用下， 生成 3,3-dimethyl-4-oxo-4-phenylbutanoic acid
  参考文献：
  名称：

  Haller; Ramart-Lucas, Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1914, vol. 159, p. 145

  摘要：

  DOI：

文献信息

• Pyridazinone
  申请人：Wunberg Tobias

  公开号：US20050059658A1

  公开（公告）日：2005-03-17

  The invention relates to novel compounds, to a method for the production of said compounds and to the use thereof as medicaments, more particularly as antiviral agents, especially against cytomegalovirus.

  本发明涉及新型化合物、制备该化合物的方法以及将其作为药物的用途，特别是作为抗病毒药物，尤其是针对巨细胞病毒。
• Method for inhibiting the replication of herpes viruses
  申请人：Betz Ulrich

  公开号：US20070004735A1

  公开（公告）日：2007-01-04

  The invention relates to a method for inhibiting the replication of herpesviruses, to methods for identifying compounds which inhibit the replication of herpesviruses using this method, to compounds having activity against herpesviruses, to methods for their preparation and to their use for producing medicaments for the treatment of herpes infections.

  本发明涉及一种抑制疱疹病毒复制的方法，使用该方法鉴定抑制疱疹病毒复制的化合物的方法，具有抗疱疹病毒活性的化合物，其制备方法以及用于制备治疗疱疹感染药物的方法。
• Direct Catalytic Anti-Markovnikov Hydroetherification of Alkenols
  作者：David S. Hamilton、David A. Nicewicz

  DOI：10.1021/ja309635w

  日期：2012.11.14

  A direct intramolecular anti-Markovnikov hydroetherification reaction of alkenols is described. By employing Catalytic quantities of commercially available 9-mesityl-10-methylacridinium perchlorate and 2-phenyl-malononitrile as a redox-cycling source of a H-atom, we report the anti-Markovnikov hydroetherification of alkenes with complete regioselectivity, In addition, we present results demonstrating that this novel catalytic system can be applied to the anti-Markovnikov hydrolactonization of alkenoic acids.
• Julia,M. et al., Bulletin de la Societe Chimique de France, 1960, p. 304 - 312
  作者：Julia,M. et al.

  DOI：——

  日期：——
• PYRIDAZINONE
  申请人：Bayer HealthCare AG

  公开号：EP1404657A1

  公开（公告）日：2004-04-07