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methyl (E)-6-n-butyl-2-i-propylcinnamate

中文名称
——
中文别名
——
英文名称
methyl (E)-6-n-butyl-2-i-propylcinnamate
英文别名
methyl (E)-3-(2-butyl-6-propan-2-ylphenyl)prop-2-enoate
methyl (E)-6-n-butyl-2-i-propylcinnamate化学式
CAS
——
化学式
C17H24O2
mdl
——
分子量
260.376
InChiKey
BANKJAQDJSONJB-VAWYXSNFSA-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):
    5.2
  • 重原子数:
    19
  • 可旋转键数:
    7
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.47
  • 拓扑面积:
    26.3
  • 氢给体数:
    0
  • 氢受体数:
    2

反应信息

  • 作为产物:
    描述:
    降冰片烯2-碘异丙基苯 在 palladium diacetate 、 2-碘异丙基苯potassium acetatepotassium carbonate 作用下, 以 N,N-二甲基甲酰胺 为溶剂, 反应 72.0h, 以24%的产率得到cis,exo 5-i-propyl-1,2,3,4,4a,8b-hexahydro-1,4-methanobiphenylene
    参考文献:
    名称:
    A catalytic process based on sequential ortho-alkylation and vinylation of ortho-alkylaryl iodides via palladacycles
    摘要:
    A new synthesis of vinylarenes selectively substituted in both their ortho positions with different alkyl groups is reported The reaction occurs starting from ortho-alkyl substituted iodoarenes which are caused to react with aliphatic iodides, terminal olefins, K2CO3, AcOK and Pd(OAc)(2) in a one-pot reaction consisting of a series of elementary steps controlled by palladium in its oxidation stales 0, II and IV. A correct balance of all the steps involved is required to obtain a catalytic reaction. (C) 1999 Elsevier Science Ltd. All rights reserved.
    DOI:
    10.1016/s0040-4020(99)00293-8
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文献信息

  • A catalytic process based on sequential ortho-alkylation and vinylation of ortho-alkylaryl iodides via palladacycles
    作者:Marta Catellani、Federica Cugini
    DOI:10.1016/s0040-4020(99)00293-8
    日期:1999.5
    A new synthesis of vinylarenes selectively substituted in both their ortho positions with different alkyl groups is reported The reaction occurs starting from ortho-alkyl substituted iodoarenes which are caused to react with aliphatic iodides, terminal olefins, K2CO3, AcOK and Pd(OAc)(2) in a one-pot reaction consisting of a series of elementary steps controlled by palladium in its oxidation stales 0, II and IV. A correct balance of all the steps involved is required to obtain a catalytic reaction. (C) 1999 Elsevier Science Ltd. All rights reserved.
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