Methyl-(α,α-dimethyl-3,5-di-tert.-butyl-benzyl)-ether | 14665-98-6

• 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: Methyl-(α,α-dimethyl-3,5-di-tert.-butyl-benzyl)-ether
• 英文别名: 1,3-Ditert-butyl-5-(2-methoxypropan-2-yl)benzene
• CAS: 14665-98-6
• 化学式: C₁₈H₃₀O
• 分子量: 262.436
• InChiKey: AYETWOCHISXUIX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.5
• 重原子数：
  19
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  9.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  Methyl-(α,α-dimethyl-3,5-di-tert.-butyl-benzyl)-ether 在 platinum(IV) oxide 氢气 作用下， 以 甲醇 为溶剂， 生成 1-Isopropyl-3,5-di-tert-butyl-benzol, 1,3-Di-tert-butyl-5-isopropyl-benzol
  参考文献：
  名称：

  Scharf,H.-D.; Doering,F., Chemische Berichte, 1967, vol. 100, p. 1761 - 1763

  摘要：

  DOI：
• 作为产物：
  描述：

  甲醇 、 2-(3,5-Di-tert-butylphenyl)-2-propanol 在 盐酸 作用下， 生成 Methyl-(α,α-dimethyl-3,5-di-tert.-butyl-benzyl)-ether
  参考文献：
  名称：

  Scharf,H.-D.; Doering,F., Chemische Berichte, 1967, vol. 100, p. 1761 - 1763

  摘要：

  DOI：

文献信息

• [EN] NOVEL TRICYCLIC CHIRAL COMPOUNDS AND THEIR USE IN ASYMMETRIC CATALYSIS<br/>[FR] NOUVEAUX COMPOSÉS CHIRAUX TRICYCLIQUES ET LEUR UTILISATION EN CATALYSE ASYMÉTRIQUE
  申请人：UNIV NANYANG

  公开号：WO2010027334A1

  公开（公告）日：2010-03-11

  The present invention relates to a compound of general Formula Formula (XX), its formation and its use in asymmetric catalysis. In Formula (XX) R and R31 are independently -COOR3, -R4COOR3, -R4CHO, -R4COR3, -R4CONR5R6, -R4COX, -R4OP(=O)(OH)2,, -R4P(=O)(OH)2), -R4C(O)C(R3)CR5R6 and -R4CO2COR3. In addition, R31 may also be hydrogen. R3, R5 and R6 are independently hydrogen, an aliphatic group with a main chain having 1 to about 20 carbon atoms, an alicyclic group, an aromatic group, an arylaliphatic group or an arylalicyclic group, comprising 0 to about 3 heteroatoms independently selected from the group consisting of N, O, S, Se and Si. R4 an aliphatic bridge with a main chain having 1 to about 20 carbon atoms, an alicyclic bridge, an aromatic bridge, an arylaliphatic bridge or an arylalicyclic bridge, comprising 0 to about 3 heteroatoms independently selected from the group consisting of N, O, S, Se and Si, and X is halogen. In Formula (XX) R30 is -C(OH)R1R2 or -COOR14, wherein R1, R2 and R14 are independently hydrogen, an aliphatic group with a main chain having 1 to about 20 carbon atoms, an alicyclic group, an aromatic group, an arylaliphatic group or an arylalicyclic group, comprising 0 to about 3 heteroatoms independently selected from the group consisting of N, O, S, Se and Si.
• Scharf,H.-D.; Doering,F., Chemische Berichte, 1967, vol. 100, p. 1761 - 1763
  作者：Scharf,H.-D.、Doering,F.

  DOI：——

  日期：——