2-[(4S)-4-tert-butyl-1-phenyl-4,5-dihydroimidazol-2-yl]propan-2-ol | 847161-72-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑烷类
• 英文名称: 2-[(4S)-4-tert-butyl-1-phenyl-4,5-dihydroimidazol-2-yl]propan-2-ol
• CAS: 847161-72-2
• 化学式: C₁₆H₂₄N₂O
• 分子量: 260.379
• InChiKey: OISJXEZIZUITOQ-CYBMUJFWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  35.8
• 氢给体数：
  1
• 氢受体数：
  2

文献信息

• Phospinite-imidazolines and metal complexes thereof
  申请人：Menges Federik

  公开号：US20070010493A1

  公开（公告）日：2007-01-11

  Compounds of the formulae (I) and (Ia) where X 1 is secondary phosphino; R 3 is a hydrocarbon radical having from 1 to 20 C atoms, a heterohydrocarbon radical which has from 2 to 20 atoms and at least one heteroatorn selected from the group consisting of O, S, NH and NR, or an —SO 2 —R radical; R is C 1 -C 18 -alkyl, phenyl or benzyl; the radicals R 4 are each, or the two radicals R4 together a hydrocarbon radical having from 1 to 20 C atoms; R 01 is a hydrocarbon radical having from 1 to 20 C atoms; and R 02 and R′ o2 are each, independently of one another, a hydrogen atom or independently have the meaning of R 01 , or R 01 and R 02 together with the C atom to which they are bound form a three- to eight-membered hydrocarbon or hetero hydrocarbon ring. The compounds are chiral ligands for complexes of metals of transition groups I and VIII which act as catalysts for asymmetric additions, for example of hydrogen, onto prochiral unsaturated organic compounds.

  化合物的公式（I）和（Ia），其中X1是二级膦基；R3是具有1至20个C原子的碳氢基团，具有2至20个原子并且至少有一个杂原子（选自O，S，NH和NR的群体）的杂碳氢基团，或者是一个—SO2—R基团；R是C1-C18-烷基，苯基或苄基；基团R4是每个，或两个基团R4共同形成具有1至20个C原子的碳氢基团；R01是具有1至20个C原子的碳氢基团；R02和R'o2各自独立地是氢原子，或者独立地具有R01的含义，或者R01和R02与它们所连接的C原子一起形成一个三至八元环的碳氢或杂环碳氢基团。这些化合物是过渡金属I和VIII族的配合物的手性配体，可作为催化剂用于对不对称不饱和有机化合物的加成反应，例如氢的加成反应。