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6-acetyl-2,3-dihydroperimidine | 1198394-91-0

中文名称
——
中文别名
——
英文名称
6-acetyl-2,3-dihydroperimidine
英文别名
1-(2,3-dihydro-1H-perimidin-6-yl)ethanone
6-acetyl-2,3-dihydroperimidine化学式
CAS
1198394-91-0
化学式
C13H12N2O
mdl
——
分子量
212.251
InChiKey
ALCUABGCMLQBKN-UHFFFAOYSA-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):
    2.7
  • 重原子数:
    16
  • 可旋转键数:
    1
  • 环数:
    3.0
  • sp3杂化的碳原子比例:
    0.15
  • 拓扑面积:
    41.1
  • 氢给体数:
    2
  • 氢受体数:
    3

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量
  • 下游产品
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    6-acetyl-2,3-dihydroperimidine 在 PPA 、 溶剂黄146 作用下, 反应 1.0h, 以63%的产率得到4(9)-acetylperimidine
    参考文献:
    名称:
    Synthesis of 2,3-dihydroperimidine ketones
    摘要:
    Ketones derived from unsubstituted 2,3-dihydroperimidine were obtained by the selective reduction of the corresponding acylperimidines. The direct acylation of 2,3-dihydroperimidine in PPA is accompanied by dehydrogenation and leads to 4(9)-acylperimidines. The spectral characteristics of these products were discussed.
    DOI:
    10.1007/s10593-009-0325-4
  • 作为产物:
    描述:
    6(7)-acetylperimidine 在 sodium tetrahydroborate 、 溶剂黄146 作用下, 反应 1.0h, 以78%的产率得到6-acetyl-2,3-dihydroperimidine
    参考文献:
    名称:
    Synthesis of 2,3-dihydroperimidine ketones
    摘要:
    Ketones derived from unsubstituted 2,3-dihydroperimidine were obtained by the selective reduction of the corresponding acylperimidines. The direct acylation of 2,3-dihydroperimidine in PPA is accompanied by dehydrogenation and leads to 4(9)-acylperimidines. The spectral characteristics of these products were discussed.
    DOI:
    10.1007/s10593-009-0325-4
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文献信息

  • Synthesis of 2,3-dihydroperimidine ketones
    作者:I. V. Borovlev、O. P. Demidov
    DOI:10.1007/s10593-009-0325-4
    日期:2009.6
    Ketones derived from unsubstituted 2,3-dihydroperimidine were obtained by the selective reduction of the corresponding acylperimidines. The direct acylation of 2,3-dihydroperimidine in PPA is accompanied by dehydrogenation and leads to 4(9)-acylperimidines. The spectral characteristics of these products were discussed.
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