2-hydroxy-2,5-dimethyl-hexanoic acid | 67019-99-2

• 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-2,5-dimethyl-hexanoic acid
• 英文别名: β-Oxy-ε-methyl-hexan-β-carbonsaeure；α-Oxy-α.δ-dimethyl-n-capronsaeure；2.5-Dimethyl-hexanol-(2)-saeure-(1)；2-Hydroxy-2,5-dimethyl-hexansaeure；2-Hydroxy-2,5-dimethylhexanoic acid
• CAS: 67019-99-2
• 化学式: C₈H₁₆O₃
• 分子量: 160.213
• InChiKey: ZDKCUUZYGNPPNX-UHFFFAOYSA-N

物化性质

• 熔点：
  82-83 °C
• 沸点：
  274.0±13.0 °C(Predicted)
• 密度：
  1.046±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  11
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  57.5
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-氧代-丙酸 3-甲基丁基酯 、 magnesium,2-methylbutane,bromide 生成 2-hydroxy-2,5-dimethyl-hexanoic acid
  参考文献：
  名称：

  Grignard, Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1902, vol. 135, p. 629

  摘要：

  DOI：

文献信息

• Solvent composition containing at least one ester of isoamylalcohol
  申请人：Oleon

  公开号：EP2327756A2

  公开（公告）日：2011-06-01

  The invention relates to a solvent composition comprising an ester of isoamyl alcohol with a C8-C14 fatty acid. The isoamyl alcohol is a component selected from the group of 3-methyl-1-butanol, 2-methyl-1-butanol, a fusel oil mixture containing 3-methyl-1-butanol, 2-methyl-1-butanol or a mixture of two or more of the afore mentioned components. The invention also relates to a creep oil, an ink composition, a coating composition or an anti-corrosion agent containing such a solvent composition.

  本发明涉及一种由异戊醇与 C8-C14 脂肪酸的酯组成的溶剂组合物。异戊醇是从 3-甲基-1-丁醇、2-甲基-1-丁醇、含有 3-甲基-1-丁醇、2-甲基-1-丁醇的燧石油混合物或上述两种或两种以上组分的混合物中选出的组分。本发明还涉及含有这种溶剂组合物的蠕变油、油墨组合物、涂料组合物或防腐剂。
• SOLVENT COMPOSITION CONTAINING AT LEAST ONE ESTER OF ISOAMYLALCOHOL
  申请人：PACKET Dirk

  公开号：US20110220845A1

  公开（公告）日：2011-09-15

  The invention relates to a solvent composition comprising an ester of isoamyl alcohol with a C8-C14 fatty acid. The isoamyl alcohol is a component selected from the group of 3-methyl-1-butanol, 2-methyl-1-butanol, a fusel oil mixture containing 3-methyl-1-butanol, 2-methyl-1-butanol or a mixture of two or more of the afore mentioned components. The invention also relates to a creep oil, an ink composition, a coating composition or an anti-corrosion agent containing such a solvent composition.