碳酸,乙烯基1-甲基丙基酯 | 153648-88-5

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机碳酸及其衍生物
• 中文名称: 碳酸,乙烯基1-甲基丙基酯
• 英文名称: (+/-)-2-butylvinyl carbonate
• 英文别名: Vinyl 2-butyl carbonate；butan-2-yl ethenyl carbonate
• CAS: 153648-88-5
• 化学式: C₇H₁₂O₃
• 分子量: 144.17
• InChiKey: TXDHLUGBRVJABC-UHFFFAOYSA-N

物化性质

• 沸点：
  176.8±13.0 °C(Predicted)
• 密度：
  0.965±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  10
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  碳酸,乙烯基1-甲基丙基酯 、 苄胺 在 4 A molecular sieve 、 immobilized lipase from Candida antarctica SP 435A 作用下， 以 正己烷 为溶剂， 反应 8.0h， 以49%的产率得到S-(+)-N-benzyl-2-butyl carbamate
  参考文献：
  名称：

  Kinetic resolution of vinyl carbonates through a lipase-mediated synthesis of their carbonate and carbamate derivatives.

  摘要：

  Lipase from Candida antarctica was used in the synthesis of different chiral carbonates and carbamates through the enzymic resolution of the starting racemic vinyl carbonates. A striking feature was the changeover of the enantioselectivity with regard to the one showed when vinyl carbonates were used in the resolution of alcohols and amines, thus the S enantiomer of the vinyl carbonate was resolved whereas the same enzyme was selective towards R ones when resolving alcohols and amines. In this way, compounds obtained beforehand as R carbonates were now achieved as S ones with better e.e.'s and shorter reaction times.

  DOI：

  10.1016/s0040-4020(01)81561-1
• 作为产物：
  描述：

  氯甲酸乙烯酯 、 仲丁醇 以 吡啶 为溶剂， 反应 2.0h， 以75%的产率得到碳酸,乙烯基1-甲基丙基酯
  参考文献：
  名称：

  Kinetic resolution of vinyl carbonates through a lipase-mediated synthesis of their carbonate and carbamate derivatives.

  摘要：

  Lipase from Candida antarctica was used in the synthesis of different chiral carbonates and carbamates through the enzymic resolution of the starting racemic vinyl carbonates. A striking feature was the changeover of the enantioselectivity with regard to the one showed when vinyl carbonates were used in the resolution of alcohols and amines, thus the S enantiomer of the vinyl carbonate was resolved whereas the same enzyme was selective towards R ones when resolving alcohols and amines. In this way, compounds obtained beforehand as R carbonates were now achieved as S ones with better e.e.'s and shorter reaction times.

  DOI：

  10.1016/s0040-4020(01)81561-1

文献信息

• VARIABLE OPTIC OPHTHALMIC DEVICE INCLUDING LIQUID CRYSTAL ELEMENTS
  申请人：Johnson & Johnson Vision Care, Inc.

  公开号：US20160363784A1

  公开（公告）日：2016-12-15

  Methods and apparatuses for providing a variable optic insert into an ophthalmic lens as set forth. An energy source is capable of powering the variable optic insert included within the ophthalmic lens. In some embodiments, an ophthalmic lens is cast-molded from a silicone hydrogel. The various ophthalmic lens entities may include electroactive liquid crystal layers to electrically control refractive characteristics.
• Kinetic resolution of vinyl carbonates through a lipase-mediated synthesis of their carbonate and carbamate derivatives.
  作者：Marcos Pozo、Vicente Gotor

  DOI：10.1016/s0040-4020(01)81561-1

  日期：1993.1

  Lipase from Candida antarctica was used in the synthesis of different chiral carbonates and carbamates through the enzymic resolution of the starting racemic vinyl carbonates. A striking feature was the changeover of the enantioselectivity with regard to the one showed when vinyl carbonates were used in the resolution of alcohols and amines, thus the S enantiomer of the vinyl carbonate was resolved whereas the same enzyme was selective towards R ones when resolving alcohols and amines. In this way, compounds obtained beforehand as R carbonates were now achieved as S ones with better e.e.'s and shorter reaction times.