2-Hydroxy-2,4-dimethyl-pentansaeure-aethylester | 10348-50-2

• 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: 2-Hydroxy-2,4-dimethyl-pentansaeure-aethylester
• 英文别名: Ethyl 2-hydroxy-2,4-dimethylpentanoate
• CAS: 10348-50-2
• 化学式: C₉H₁₈O₃
• 分子量: 174.24
• InChiKey: RVVPDHUIQGSSIE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  12
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.89
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-Hydroxy-2,4-dimethyl-pentansaeure-aethylester 在 sodium hydroxide 作用下， 生成 2-羟基-2,4-二甲基戊酸
  参考文献：
  名称：

  Klimova,E.; Arbuzov,Yu., Doklady Chemistry, 1966, vol. 167, p. 419 - 421

  摘要：

  DOI：
• 作为产物：
  描述：

  ethyl 2-hydroxy-2,4-dimethylpent-4-enoate 在 platinum(IV) oxide 氢气 作用下， 以 乙醇 为溶剂， 生成 2-Hydroxy-2,4-dimethyl-pentansaeure-aethylester
  参考文献：
  名称：

  Klimova,E.; Arbuzov,Yu., Doklady Chemistry, 1966, vol. 167, p. 419 - 421

  摘要：

  DOI：

文献信息

• Process for Producing alpha-Trifluoromethyl-alpha,beta-Unsaturated Ester
  申请人：Ishii Akihiro

  公开号：US20110160477A1

  公开（公告）日：2011-06-30

  An α-trifluoromethyl-α,β-unsaturated ester can be produced by reacting an α-trifluoromethyl-α-hydroxy ester with sulfuryl fluoride (SO 2 F 2 ) in the presence of an organic base. It is preferable that the raw substrate has a hydrogen atom as one β-position substituent group and either an alkyl group, a substituted alkyl group, an alkenyl group, a substituted alkenyl group, an aromatic ring group or a substituted aromatic ring group as the other β-position substituent group. It is more preferable that an ester moiety of the raw substrate is an alkyl ester. This raw substrate is readily available. Further, the desired reaction can proceed favorably with the use of this raw substrate. It is also preferable to use either 1,5-diazabicyclo[4.3.0]non-5-ene (DBN) or 1,8-diazabicyclo[5.4.0]undec-7-ene (DBU) as the organic base. The desired reaction can proceed more favorably with the use of this organic base.
• US8653295B2
  申请人：——

  公开号：US8653295B2

  公开（公告）日：2014-02-18
• Klimova,E.; Arbuzov,Yu., Doklady Chemistry, 1966, vol. 167, p. 419 - 421
  作者：Klimova,E.、Arbuzov,Yu.

  DOI：——

  日期：——