3-tert-butoxycarbonylamino-2,6-dimethyl-4-trifluoromethylpyridine | 754989-48-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 3-tert-butoxycarbonylamino-2,6-dimethyl-4-trifluoromethylpyridine
• 英文别名: tert-butyl N-[2,6-dimethyl-4-(trifluoromethyl)pyridin-3-yl]carbamate
• CAS: 754989-48-5
• 化学式: C₁₃H₁₇F₃N₂O₂
• 分子量: 290.285
• InChiKey: POAICWIBBFUQDX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  51.2
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  3-tert-butoxycarbonylamino-2,6-dimethyl-4-trifluoromethylpyridine 在 盐酸 作用下， 以 甲醇 为溶剂， 反应 12.0h， 以82%的产率得到3-amino-2,6-dimethyl-4-trifluoromethylpyridine dihydrochloride
  参考文献：
  名称：

  METHOD FOR PRODUCING CYCLIC DIAMINE DERIVATIVE OR SALT THEREOF

  摘要：

  公开号：

  EP1627875B1
• 作为产物：
  描述：

  2,6-dimethyl-4-(trifluoromethyl)pyridine-3-carboxylic acid hydrochloride 、 叔丁醇 在 叠氮磷酸二苯酯 、 三乙胺 作用下， 反应 3.0h， 以68%的产率得到3-tert-butoxycarbonylamino-2,6-dimethyl-4-trifluoromethylpyridine
  参考文献：
  名称：

  METHOD FOR PRODUCING CYCLIC DIAMINE DERIVATIVE OR SALT THEREOF

  摘要：

  公开号：

  EP1627875B1

文献信息

• Process for producing acid adduct salt of polyacidic base compound
  申请人：Shibuya Kimiyuki

  公开号：US20060079688A1

  公开（公告）日：2006-04-13

  This invention relates to a method for preparing an acid addition salt of a polyacidic basic compound, or a water adduct having basic site(s) stronger than pyridine. The method comprises reacting the polyacidic basic compound with an acid salt of pyridine. By the present invention, the number of moles of an added acid in the acid addition salt of the polyacidic basic compound can be readily changed to a number suited for the polyacidic basic compound as needed.

  本发明涉及一种制备多酸性碱性化合物的酸加成盐或具有比吡啶更强碱性位点的水加合物的方法。该方法包括将多酸性碱性化合物与吡啶酸盐反应。通过本发明，可以根据需要轻松地改变添加的酸的摩尔数，以适合多酸性碱性化合物。
• Method for producing cyclic diamine derivative or salt thereof
  申请人：Shibuya Kimiyuki

  公开号：US20060293519A1

  公开（公告）日：2006-12-28

  The present invention is directed to a method for producing a cyclic diamine compound (3) or a salt thereof through the following scheme: (wherein Ar represents a phenyl group, a pyridyl group, or a pyrimidinyl group, any of which may have a substituent; X represents NH, S, or O; ring A represents a benzene ring or a pyridine ring, which may have a substituent; 1 represents an integer of 1 or 2; m represents an integer of 1 or 2; and n represents an integer of 1 to 6). The method enables synthesis of a cyclic diamine compound (3) or a salt thereof, which serves as an ACAT inhibitor, in an industrially useful manner.

  本发明涉及通过以下方案制备环状二胺化合物（3）或其盐的方法：（其中Ar代表苯基、吡啶基或嘧啶基，任何一个可能有取代基；X代表NH、S或O；环A代表苯环或吡啶环，可能有取代基；1表示1或2的整数；m表示1或2的整数；n表示1到6的整数）。该方法能够以工业上有用的方式合成环状二胺化合物（3）或其盐，其作为ACAT抑制剂。
• METHOD FOR PREPARING ACID ADDITION SALTS OF POLYACIDIC BASIC COMPOUNDS
  申请人：Shibuya Kimiyuki

  公开号：US20100234599A1

  公开（公告）日：2010-09-16

  This invention relates to a method for preparing an acid addition salt of a polyacidic basic compound, or a water adduct having basic site(s) stronger than pyridine. The method comprises reacting the polyacidic basic compound with an acid salt of pyridine. By the present invention, the number of moles of an added acid in the acid addition salt of the polyacidic basic compound can be readily changed to a number suited for the polyacidic basic compound as needed.

  本发明涉及一种制备多酸性碱性化合物的酸加成盐或具有比吡啶更强碱位的水加合物的方法。该方法包括将多酸性碱性化合物与吡啶酸盐反应。通过本发明，可以根据需要轻松改变酸加成盐中添加的酸的摩尔数，以适应多酸性碱性化合物。
• Method for preparing acid addition salts of polyacidic basic compounds
  申请人：Shibuya Kimiyuki

  公开号：US08518936B2

  公开（公告）日：2013-08-27

  Monohydrochloride acid addition salts of a polyacidic basic compound, or a water adduct having basic site(s) stronger than pyridine. These monohydrochlorides can be produced by reacting a polyacidic basic compound with an acid salt of pyridine.

  一种多酸性碱性化合物的单盐酸加成盐，或者是具有比吡啶更强碱性位点的水加合物。这些单盐酸可以通过将多酸性碱性化合物与吡啶的酸盐反应而制得。
• PROCESS FOR PRODUCING ACID ADDUCT SALT OF POLYACIDIC BASE COMPOUND
  申请人：Kowa Co., Ltd.

  公开号：EP1598346B1

  公开（公告）日：2012-04-18