acetic acid-(3-fluoro-[2]pyridyl ester) | 2267-37-0

• 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: acetic acid-(3-fluoro-[2]pyridyl ester)
• 英文别名: Essigsaeure-(3-fluor-[2]pyridylester)；2-Pyridinol, 3-fluoro-, 2-acetate；(3-fluoropyridin-2-yl) acetate
• CAS: 2267-37-0
• 化学式: C₇H₆FNO₂
• 分子量: 155.129
• InChiKey: DBSKIKIWLHLMKL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  11
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  39.2
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  acetic acid-(3-fluoro-[2]pyridyl ester) 在 盐酸 作用下， 生成 3-氟-2-羟基吡啶
  参考文献：
  名称：

  Pyridine Derivatives. III. The Rearrangement of Some Simple 3-Halopyridine-N-oxides¹

  摘要：

  DOI：

  10.1021/jo01105a008
• 作为产物：
  描述：

  3-氟吡啶 、 乙酰基次氟酸酯 以 氯仿 为溶剂， 以70%的产率得到acetic acid-(3-fluoro-[2]pyridyl ester)
  参考文献：
  名称：

  Oxygenation of the Unactivated Pyridine System by Acetyl Hypofluorite Made Directly from F2

  摘要：

  DOI：

  10.3987/com-88-s5

文献信息

• PYRIDAZINE COMPOUND AND USE THEREOF
  申请人：Sumitomo Chemical Company, Limited

  公开号：EP1958946A1

  公开（公告）日：2008-08-20

  A pyridazine compound of the formula: has an excellent plant disease controlling effect.

  式中的哒嗪化合物： 具有极佳的植物病害控制效果。
• Utilizing acetyl hypofluorite for chlorination, bromination, and etherification of the pyridine system
  作者：David Hebel、Shlomo Rozen

  DOI：10.1021/jo00022a016

  日期：1991.10

  Acetyl hypofluorite, which is easily made from F2, possesses a strong electrophilic fluorine. This electrophile is able to attach itself to the nitrogen atom of pyridine and activate the ring toward nucleophilic attacks. The ultimate elimination of HF results in an overall easy nucleophilic displacement of the hydrogen of the important 2-position. The nucleophiles used; Cl-delta-, Br-delta-, and RO-delta-, originate from solvents such as CH2Cl2, CH2Br2, and various primary alcohols. Thus, 2-halo- or 2-alkoxypyridines were formed. The reaction conditions (room temperature, very short reaction times, and good yields) transform the task of direct substitution of the pyridine ring from an extremely difficult to a very easy procedure.
• 1,4-OXAZEPANE DERIVATIVES
  申请人：Takeda Pharmaceutical Company Limited

  公开号：EP2625170A1

  公开（公告）日：2013-08-14
• TRIAZOLO-PYRIMIDINE COMPOUNDS AND USES THEREOF
  申请人：DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD

  公开号：EP3849983A1

  公开（公告）日：2021-07-21
• [EN] 1,4-OXAZEPANE DERIVATIVES<br/>[FR] DÉRIVÉS DE 1,4-OXAZÉPANE
  申请人：TAKEDA PHARMACEUTICAL

  公开号：WO2012046882A1

  公开（公告）日：2012-04-12

  Provided is a compound having a monoamine reuptake inhibitory activity, which is represented by the formula (I) wherein ring A is an optionally substituted 6-membered aromatic ring, ring B is the substituents on ring A are optionally bonded to form, together with ring A, an optionally substituted 9- or 10-membered aromatic fused ring, and other symbols are as defined in the specification, or a salt thereof.