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| 1072846-98-0

中文名称
——
中文别名
——
英文名称
——
英文别名
——
化学式
CAS
1072846-98-0
化学式
C13H17Br4NO2
mdl
——
分子量
538.899
InChiKey
PDPNIVMDWXHNJR-FXAINCCUSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    4.05
  • 重原子数:
    20.0
  • 可旋转键数:
    6.0
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.69
  • 拓扑面积:
    30.49
  • 氢给体数:
    1.0
  • 氢受体数:
    3.0

反应信息

  • 作为反应物:
    描述:
    3-溴丙烯potassium carbonate 作用下, 以 丙酮 为溶剂, 生成 N-prop-2-enyl-N-[[(1R,2R,4S)-1,4,5,6-tetrabromo-7,7-dimethoxy-2-bicyclo[2.2.1]hept-5-enyl]methyl]prop-2-en-1-amine
    参考文献:
    名称:
    A stereoselective C7nC5x free-radical cascade route to optically pure and potentially useful tetracyclic amines
    摘要:
    Nucleophilic racemic amines have been synthesized utilizing a (CC5x)-C-7n free-radical cascade reaction from a bis-allyl amine starting material. Being potentially useful organocatalytic bases as is evident from their screening in the Baylis-Hillman reaction, optically pure amines were also synthesized from optically pure aldehydes (-) or (+)-4. Bis-allyl amides under similar radical reaction condition resulted in C-7n cyclized products. (C) 2008 Elsevier Ltd. All rights reserved.
    DOI:
    10.1016/j.tetlet.2008.08.013
  • 作为产物:
    描述:
    在 sodium tetrahydroborate 作用下, 反应 4.0h, 生成
    参考文献:
    名称:
    A stereoselective C7nC5x free-radical cascade route to optically pure and potentially useful tetracyclic amines
    摘要:
    Nucleophilic racemic amines have been synthesized utilizing a (CC5x)-C-7n free-radical cascade reaction from a bis-allyl amine starting material. Being potentially useful organocatalytic bases as is evident from their screening in the Baylis-Hillman reaction, optically pure amines were also synthesized from optically pure aldehydes (-) or (+)-4. Bis-allyl amides under similar radical reaction condition resulted in C-7n cyclized products. (C) 2008 Elsevier Ltd. All rights reserved.
    DOI:
    10.1016/j.tetlet.2008.08.013
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