N-Methyl-2-ethyl-2-butylhexylamin | 20720-02-9

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: N-Methyl-2-ethyl-2-butylhexylamin
• 英文别名: N-Methyl-2-aethyl-2-butyl-hexylamin；2-butyl-2-ethyl-N-methylhexan-1-amine
• CAS: 20720-02-9
• 化学式: C₁₃H₂₉N
• 分子量: 199.38
• InChiKey: MFMROSXMJMNHQF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  14
• 可旋转键数：
  9
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  12
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  聚合甲醛 、 N-Methyl-2-ethyl-2-butylhexylamin 在 铂 氢气 作用下， 生成 N,N-Dimethyl-2-ethyl-2-butylhexylamine
  参考文献：
  名称：

  The Synthesis of Aldehydes from the Reaction of Amines with Butadiene

  摘要：

  DOI：

  10.1021/jo01349a053
• 作为产物：
  描述：

  1,3-丁二烯 、 甲胺 生成 N-Methyl-2-ethyl-2-butylhexylamin
  参考文献：
  名称：

  The Synthesis of Aldehydes from the Reaction of Amines with Butadiene

  摘要：

  DOI：

  10.1021/jo01349a053

文献信息

• [EN] THIOLACTONE ANTIBIOTICS<br/>[FR] ANTIBIOTIQUES DE THIOLACTONE
  申请人：UNIV NEW YORK STATE RES FOUND

  公开号：WO2012135027A2

  公开（公告）日：2012-10-04

  This invention provides a compound having the structure (I) wherein R1 is H, (II) or (III), wherein n and q are independently an integer from 0 to 8; A is absent or present and when present is (IV), (V), (VI), (VII), (VIII), or (IX), wherein m is an integer from 0 to 8; R3 is an amino, alkyl, aryl, heteroaryl, diol, piperazine, morpholine, piperidine, triazole, azide or biphenyl, each with or without substitution, branched or unbranched, or (X); and R4 is alkyl, aryl, or heteroaryl, each with or without substitution, branched or unbranched, R2 is H, CH3, or alkyl, aryl, heteroaryl, pyrrole, diazole, or triazole, each with or without substitution, branched or unbranched, or (XI), wherein n and q are independently an integer from 0 to 8; A is absent or present and when present is (IV), (V), (VI), (VII), or (VIII); and R6 is azide, methoxy, trifluoromethyl, biphenyl, substituted phenyl, substituted triazole, or alkyl, aryl or heteroaryl, with or without substitution, branched or unbranched, when R1 is H then R2 is other than H or CH3, and when R2 is H or CH3 then R1 is other than H, or a pharmaceutically acceptable salt thereof.
• The Synthesis of Aldehydes from the Reaction of Amines with Butadiene
  作者：Ernest A. Zuech、Roger F. Kleinschmidt、John E. Mahan

  DOI：10.1021/jo01349a053

  日期：1966.11