(R)-1-(2-Fluorophenyl)propan-1-amine | 1168139-58-9

• 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)-1-(2-Fluorophenyl)propan-1-amine
• 英文别名: (1R)-1-(2-fluorophenyl)propan-1-amine
• CAS: 1168139-58-9
• 化学式: C₉H₁₂FN
• 分子量: 153.2
• InChiKey: CQTLDYYIWIOAAV-SECBINFHSA-N

物化性质

• 沸点：
  201.0±15.0 °C(Predicted)
• 密度：
  1.039±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  11
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  26
• 氢给体数：
  1
• 氢受体数：
  2

文献信息

• Optically active 1-(fluoro-, trifluoromethyl-or trifluoromethoxy-substituted phenyl) alkylamine n-monoalkyl derivatives and process for producing same
  申请人：——

  公开号：US20040235961A1

  公开（公告）日：2004-11-25

  An optically active 1-(fluoro-, trifluoromethyl- or trifluoromethoxy-substituted phenyl)alkylamine N-monoalkyl derivative represented by the formula 4 is produced by a process including (a) reacting an optically active secondary amine, represented by the formula 1, with an alkylation agent R 2 —X, in the presence of a base, thereby converting the secondary amine into an optically active tertiary amine represented by the formula 3; and (b) subjecting the tertiary amine to a hydrogenolysis, thereby producing the N-monoalkyl derivative, 1 wherein R represents a fluorine atom, trifluoromethyl group or trifluoromethoxy group, n represents an integer of from 1 to 5, each of R 1 and R 2 independently represents an alkyl group having a carbon atom number of from 1 to 6, Me represents a methyl group, Ar represents a phenyl group or 1- or 2-naphthyl group, * represents a chiral carbon, and X represents a leaving group.

  以式 4 为代表的光学活性 1-(氟、三氟甲基或三氟甲氧基取代苯基)烷基胺 N-单 烷基衍生物的制备方法包括 (a) 式 1 所代表的光学活性仲胺与烷基化剂 R 2 -X，在碱存在下反应，从而将仲胺转化为由式 3 表示的光学活性叔胺；以及 (b) 将叔胺进行氢解，从而生成 N-单烷基衍生物、 1 其中 R 代表氟原子、三氟甲基或三氟甲氧基，n 代表 1 至 5 的整数，每个 R 1 和 R 2 分别代表碳原子数为 1 至 6 的烷基，Me 代表甲基，Ar 代表苯基或 1 或 2-萘基，* 代表手性碳，X 代表离去基团。
• METHOD FOR PRODUCING OPTICALLY ACTIVE 1-(FLUORO-, TRIFLUOROMETHYL- OR TRIFLUOROMETHOXY-SUBSTITUTED PHENYL)ALKYLAMINE N-MONOALKYL DERIVATIVE
  申请人：Central Glass Co., Ltd.

  公开号：EP2036881B1

  公开（公告）日：2013-09-25
• OPTICALLY ACTIVE 1-(FLUORO-,TRIFLUOROMETHYL-OR TRIFLUOROMETHOXY-SUBSTITUTED PHENYL)ALKYLAMINE N-MONOALKYL DERIVATIVES AND PROCESS FOR PRODUCING SAME
  申请人：CENTRAL GLASS COMPANY, LIMITED

  公开号：EP1530562B1

  公开（公告）日：2011-11-30
• Optically active 1-(fluoro-, trifluoromethyl- or trifluoromethoxy- substituted phenyl)alkylamine N-monoalkyl derivatives and process for producing same
  申请人：Ishii Akihiro

  公开号：US20070142670A1

  公开（公告）日：2007-06-21

  An optically active 1-(fluoro-, trifluoromethyl- or trifluoromethoxy-substituted phenyl)alkylamine N-monoalkyl derivative represented by the formula 4 is produced by a process including (a) reacting an optically active secondary amine, represented by the formula 1, with an alkylation agent R 2 —X, in the presence of a base, thereby converting the secondary amine into an optically active tertiary amine represented by the formula 3; and (b) subjecting the tertiary amine to a hydrogenolysis, thereby producing the N-monoalkyl derivative, wherein R represents a fluorine atom, trifluoromethyl group or trifluoromethoxy group, n represents an integer of from 1 to 5, each of R 1 and R 2 independently represents an alkyl group having a carbon atom number of from 1 to 6, Me represents a methyl group, Ar represents a phenyl group or 1- or 2-naphthyl group, * represents a chiral carbon, and X represents a leaving group.
• Method for Producing Optically Active 1-(Fluoro-, Trifluoromethyl- or Trifluoromethoxy-Substituted Phenyl) Alkylamine N-Monoalkyl Derivative
  申请人：Ishii Akihiro

  公开号：US20090326272A1

  公开（公告）日：2009-12-31

  There is provided a method for producing an optically active 1-(fluoro-, trifluoromethyl- or trifluoromethoxy-substituted phenyl)alkylamine N-monoalkyl derivative, which includes the steps of conducting reductive alkylation of an optically active secondary amine and a formaldehyde (including an equivalent thereof) or lower aldehyde in the presence of a transition metal catalyst under a hydrogen gas atmosphere, thereby converting the secondary amine to an optically active tertiary amine of the formula, and subjecting the tertiary amine to hydrogenolysis. The target optically active compound can be produced efficiently by this production method.