(2R,3R)-benzylammonium-2-benzyl-3-(4-bromo-2-fluoro-phenyl)-3-hydroxy-propionic acid | 444993-16-2

• 分子结构分类: 有机化合物 - 木脂素、新木脂素和相关化合物
• 英文名称: (2R,3R)-benzylammonium-2-benzyl-3-(4-bromo-2-fluoro-phenyl)-3-hydroxy-propionic acid
• 英文别名: benzylazanium;(2R,3R)-2-benzyl-3-(4-bromo-2-fluorophenyl)-3-hydroxypropanoate
• CAS: 444993-16-2
• 化学式: C₇H₉N*C₁₆H₁₄BrFO₃
• 分子量: 460.343
• InChiKey: XSWFDHDDCOUKRZ-PBCQUBLHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.71
• 重原子数：
  29
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  88
• 氢给体数：
  2
• 氢受体数：
  4

文献信息

• Intermediates and processes for preparing substituted chromanol derivatives
  申请人：Pfizer Inc.

  公开号：US20030158428A1

  公开（公告）日：2003-08-21

  The invention relates to processes for preparing a compound of the formula 1 and the enantiomer of said compound, wherein the benzoic acid moiety is attached at position 6 or 7 of the chroman ring, and R 1 , R 2 , and R 3 are as defined herein. The invention further relates to intermediates that are useful in the preparation of the compound of formula X above.

  该发明涉及制备式1化合物及其对映体的过程，其中苯甲酸基团附着在色苷环的6位或7位，并且R1、R2和R3如本文所定义。该发明还涉及在制备上述式X化合物过程中有用的中间体。
• [EN] PROCESSES FOR PREPARING CHROMANYLBENZOIC ACIDS<br/>[FR] PROCEDES DE PREPARATION D'ACIDES CHROMANYLBENZOIQUES
  申请人：PFIZER PROD INC

  公开号：WO2002060888A1

  公开（公告）日：2002-08-08

  The invention relates to processes for preparing a compound of the formula X and the enantiomer of said compound, wherein the benzoic acid moiety is attached at position (6) or (7) of the chroman ring, and R?1, R2, and R3¿ are as defined herein. The invention further relates to intermediates that are useful in the preparation of the compound of formula X above.