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2,3,4,6,7,8-hexahydro-7-methyl-1-trifluoroacetyl-5(1H)-quinolinone | 1454286-91-9

中文名称
——
中文别名
——
英文名称
2,3,4,6,7,8-hexahydro-7-methyl-1-trifluoroacetyl-5(1H)-quinolinone
英文别名
(7S)-7-methyl-1-(2,2,2-trifluoroacetyl)-2,3,4,6,7,8-hexahydroquinolin-5-one
2,3,4,6,7,8-hexahydro-7-methyl-1-trifluoroacetyl-5(1H)-quinolinone化学式
CAS
1454286-91-9
化学式
C12H14F3NO2
mdl
——
分子量
261.244
InChiKey
VZNJOZZCFFKNGQ-ZETCQYMHSA-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):
    1.9
  • 重原子数:
    18
  • 可旋转键数:
    0
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.67
  • 拓扑面积:
    37.4
  • 氢给体数:
    0
  • 氢受体数:
    5

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

反应信息

  • 作为反应物:
    描述:
    2,3,4,6,7,8-hexahydro-7-methyl-1-trifluoroacetyl-5(1H)-quinolinone 、 manganese triacetate 以 为溶剂, 反应 30.0h, 生成 [(7S)-7-methyl-5-oxo-1-(2,2,2-trifluoroacetyl)-2,3,4,6,7,8-hexahydroquinolin-6-yl] acetate
    参考文献:
    名称:
    Mn(OAc)3-Based α’-Oxidative Acetoxylation of N-Trifluoroacetyl Vinylogous Amides
    摘要:
    Vinylogous amides 1 and 11 are oxidized by dried Mn(OAc)(3) in benzene at 90 degrees C to pyridines 5 and 12, respectively, whereas the analogous N-trifluoroacetyl vinylogous amides 6 and 13 are oxidized by dried Mn(OAc)(3) in benzene at 120 degrees C to give acetates 7 and 14. The alpha'-oxo radicals that are generated in this oxidation cyclize to proximal double bonds to give tricylic alkenes such as 20.
    DOI:
    10.3987/com-12-s(n)95
  • 作为产物:
    描述:
    (S)-7-Methyl-2,3,4,6,7,8-hexahydro-1H-quinolin-5-one三氟乙酸酐三乙胺 作用下, 以 二氯甲烷 为溶剂, 反应 1.0h, 以95%的产率得到2,3,4,6,7,8-hexahydro-7-methyl-1-trifluoroacetyl-5(1H)-quinolinone
    参考文献:
    名称:
    Mn(OAc)3-Based α’-Oxidative Acetoxylation of N-Trifluoroacetyl Vinylogous Amides
    摘要:
    Vinylogous amides 1 and 11 are oxidized by dried Mn(OAc)(3) in benzene at 90 degrees C to pyridines 5 and 12, respectively, whereas the analogous N-trifluoroacetyl vinylogous amides 6 and 13 are oxidized by dried Mn(OAc)(3) in benzene at 120 degrees C to give acetates 7 and 14. The alpha'-oxo radicals that are generated in this oxidation cyclize to proximal double bonds to give tricylic alkenes such as 20.
    DOI:
    10.3987/com-12-s(n)95
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文献信息

  • Mn(OAc)3-Based α’-Oxidative Acetoxylation of N-Trifluoroacetyl Vinylogous Amides
    作者:Barry B. Snider、Hong-Yu Lin
    DOI:10.3987/com-12-s(n)95
    日期:——
    Vinylogous amides 1 and 11 are oxidized by dried Mn(OAc)(3) in benzene at 90 degrees C to pyridines 5 and 12, respectively, whereas the analogous N-trifluoroacetyl vinylogous amides 6 and 13 are oxidized by dried Mn(OAc)(3) in benzene at 120 degrees C to give acetates 7 and 14. The alpha'-oxo radicals that are generated in this oxidation cyclize to proximal double bonds to give tricylic alkenes such as 20.
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