(R)-N-(4'-chlorobenzylidene)-2-aminobutane-1-ol

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (R)-N-(4'-chlorobenzylidene)-2-aminobutane-1-ol
• 化学式: C₁₁H₁₄ClNO
• 分子量: 211.691
• InChiKey: VDQBJXFTXLPDIX-ZTFCMROMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.53
• 重原子数：
  14.0
• 可旋转键数：
  4.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  32.59
• 氢给体数：
  1.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  (R)-N-(4'-chlorobenzylidene)-2-aminobutane-1-ol 在 sodium tetrahydroborate 作用下， 以 甲醇 为溶剂， 以81%的产率得到(R)-2-(4-Chloro-benzylamino)-butan-1-ol
  参考文献：
  名称：

  Kumar, G. Biju; Shah, A. C., Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1996, vol. 35, # 1, p. 79 - 82

  摘要：

  DOI：
• 作为产物：
  描述：

  4-氯苯甲醛 、 2-氨基丁醇 以 甲苯 为溶剂， 以81%的产率得到(R)-N-(4'-chlorobenzylidene)-2-aminobutane-1-ol
  参考文献：
  名称：

  Kumar, G. Biju; Shah, A. C., Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1996, vol. 35, # 1, p. 79 - 82

  摘要：

  DOI：

文献信息

• Synthesis and molecular structure of optically active oxazolidine complexes of platinum(II) and palladium(II)
  作者：A. Albinati、F. Lianza、H. Berger、C. Arz、P.S. Pregosin

  DOI：10.1016/s0020-1693(00)92422-8

  日期：1992.8

  Two series of optically active complexes of the type trans-PtCl2(C2H4)(oxazolidine) (3) and trans-PdCl2(PPh3)(Oxazolidine) (4), oxazolidine=NHCH(p-ClC6H4)OCH2CHR (R=a, Me; b, Et; c, Bu(i); d, Bz; e, Ph) have been prepared and characterized. The synthesis involves metal promoted cyclization of the optically active Schiff's bases p-ClC6H4CH=NCH(R)CH2OH and proceeds for both metal centers in high chemical and optical yield (diastereomeric excesses of 78-96%). Attack of the oxygen at the imine carbon results in preferential formation of complexed five-membered rings which have the cis-geometry with respect to the C-2 and C-5 substituents. The solid-state structures for 3b and 4c have been determined by X-ray diffraction. Both structures reveal expected coordination spheres with the MCl2 (C2H4 or PPh3) fragment occupying a pseudo trans position with respect to the oxazolidine C-2, C-5 substituents. This observation, combined with solution 2-D NOESY measurements, is used to rationalize the observed diastereomeric excesses. Crystallographic data for the complexes are as follows: 3b, orthorhombic, space group P2(1)2(1)2(1), a=7.003(1), b=16.573(1), c=29.088(4) angstrom, V=3376.1(7) angstrom3, Z=8; 4c, orthorhombic space group P2(1)2(1)2(1), a=11.921(2), b=12.241(1), c=21.107(2) angstrom, V=3080(1) angstrom3, Z=4. The structures have been refined to R factors of 0.04 and 0.05, respectively.
• Kumar, G. Biju; Shah, A. C., Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1996, vol. 35, # 1, p. 79 - 82
  作者：Kumar, G. Biju、Shah, A. C.

  DOI：——

  日期：——