3-aminobutyric acid allyl ester | 803738-43-4

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 3-aminobutyric acid allyl ester
• 英文别名: Prop-2-enyl 3-aminobutanoate
• CAS: 803738-43-4
• 化学式: C₇H₁₃NO₂
• mdl: MFCD19207485
• 分子量: 143.186
• InChiKey: PBOFCQIFZLJXHG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.2
• 重原子数：
  10
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.571
• 拓扑面积：
  52.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3-aminobutyric acid allyl ester 在 三乙胺 、 三苯基膦 、 偶氮二甲酸二乙酯 作用下， 以 二氯甲烷 、 甲苯 为溶剂， 反应 0.67h， 生成 3-[{3-[[5-(tert-butyldimethylsilanyloxy)pentyl](2-nitrobenzenesulfonyl)amino]propyl}(2-nitrobenzenesulfonyl)amino]butyric acid allyl ester
  参考文献：
  名称：

  Efficient macrocyclization by means of 2-nitrobenzenesulfonamide and total synthesis of lipogrammistin-A

  摘要：

  Synthesis of medium- and large-sized cyclic amines using alkylation with 2-nitrobenzenesulfonamides is described. Using either conventional alkylation procedures or Mitsunobu conditions, the cyclization reaction proceeded in a highly efficient manner. The usefulness of this methodology has been fully demonstrated in the total synthesis of lipogrammistin-A (9), an 18-membered cyclic polyamine. (C) 2002 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4020(02)00626-9
• 作为产物：
  描述：

  DL-3-氨基-N-丁酸 、 烯丙醇 在 氯化亚砜 作用下， 反应 15.0h， 以43%的产率得到3-aminobutyric acid allyl ester
  参考文献：
  名称：

  Efficient macrocyclization by means of 2-nitrobenzenesulfonamide and total synthesis of lipogrammistin-A

  摘要：

  Synthesis of medium- and large-sized cyclic amines using alkylation with 2-nitrobenzenesulfonamides is described. Using either conventional alkylation procedures or Mitsunobu conditions, the cyclization reaction proceeded in a highly efficient manner. The usefulness of this methodology has been fully demonstrated in the total synthesis of lipogrammistin-A (9), an 18-membered cyclic polyamine. (C) 2002 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4020(02)00626-9

文献信息

• Process for the preparation of optically active chiral amines
  申请人：Lonza AG

  公开号：EP1818411A1

  公开（公告）日：2007-08-15

  The present invention relates to the production of optically pure secondary amines, which can be used as intermediate products in a synthesis of for instance pharmaceutical products.

  本发明涉及光学纯的仲胺的生产，这些仲胺可用作合成医药产品等的中间产品。
• Process for preparation of optically active amines by optical resolution of racemic amines employing a bacterial omega-transaminase
  申请人：Lonza AG

  公开号：EP1897956A1

  公开（公告）日：2008-03-12

  The present invention relates to the production of optically active amines, which can be used as intermediate products in a synthesis of for instance pharmaceutical products.

  本发明涉及光学活性胺的生产，这种胺可用作合成医药产品等的中间产品。
• A process for the identification and preparation of a (R)-specific omega-transaminase
  申请人：Lonza AG

  公开号：EP2862938A2

  公开（公告）日：2015-04-22

  The present invention relates to processes for the screening, preparation and characterization of (R)-selective ω-transaminases, to transaminases obtained thereby and their uses in various transamination processes.

  本发明涉及(R)-选择性ω-转氨酶的筛选、制备和表征工艺，涉及由此获得的转氨酶及其在各种转氨酶工艺中的用途。
• Fujiwara; Kan; Fukuyama, Synlett, 2000, # 11, p. 1667 - 1669
  作者：Fujiwara、Kan、Fukuyama

  DOI：——

  日期：——
• PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE CHIRAL AMINES
  申请人：Lonza AG

  公开号：EP1987152A1

  公开（公告）日：2008-11-05