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3-(β,β-dimethylvinyl)quinoline | 102210-66-2

中文名称
——
中文别名
——
英文名称
3-(β,β-dimethylvinyl)quinoline
英文别名
3-(2-Methyl-propenyl)-quinoline;3-(2-methylprop-1-enyl)quinoline
3-(β,β-dimethylvinyl)quinoline化学式
CAS
102210-66-2
化学式
C13H13N
mdl
——
分子量
183.253
InChiKey
HUJXHLCTMRQNIP-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

物化性质

  • 沸点:
    298.8±9.0 °C(Predicted)
  • 密度:
    1.052±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

  • 辛醇/水分配系数(LogP):
    3.8
  • 重原子数:
    14
  • 可旋转键数:
    1
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.15
  • 拓扑面积:
    12.9
  • 氢给体数:
    0
  • 氢受体数:
    1

反应信息

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文献信息

  • ACYCLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS
    申请人:Sun Ying
    公开号:US20080125444A1
    公开(公告)日:2008-05-29
    The present invention discloses compounds of formula I or pharmaceutically acceptable salts, esters, or prodrugs thereof: which inhibit serine protease activity, particularly the activity of hepatitis C virus (HCV) NS3-NS4A protease. Consequently, the compounds of the present invention interfere with the life cycle of the hepatitis C virus and are also useful as antiviral agents. The present invention further relates to pharmaceutical compositions comprising the aforementioned compounds for administration to a subject suffering from HCV infection. The invention also relates to methods of treating an HCV infection in a subject by administering a pharmaceutical composition comprising the compounds of the present invention.
  • OXIMYL HCV SERINE PROTEASE INHIBITORS
    申请人:GAI YONGHUA
    公开号:US20090155210A1
    公开(公告)日:2009-06-18
    The present invention discloses compounds of formula I or pharmaceutically acceptable salts, esters, or prodrugs thereof: which inhibit serine protease activity, particularly the activity of hepatitis C virus (HCV) NS3-NS4A protease. Consequently, the compounds of the present invention interfere with the life cycle of the hepatitis C virus and are also useful as antiviral agents. The present invention further relates to pharmaceutical compositions comprising the aforementioned compounds for administration to a subject suffering from HCV infection. The invention also relates to methods of treating an HCV infection in a subject by administering a pharmaceutical composition comprising the compounds of the present invention.
  • FLUORINATED TRIPEPTIDE HCV SERINE PROTEASE INHIBITORS
    申请人:GAI YONGHUA
    公开号:US20090197888A1
    公开(公告)日:2009-08-06
    The present invention relates to compounds of Formula I, or a pharmaceutically acceptable salt, ester, or prodrug, thereof: which inhibit serine protease activity, particularly the activity of hepatitis c virus (HCV) NS3-NS4A protease. Consequently, the compounds of the present invention interfere with the life cycle of the hepatitis c virus and are also useful as antiviral agents. The present invention further relates to pharmaceutical compositions comprising the aforementioned compounds for administration to a subject suffering from HCV infection. The invention also relates to methods of treating an HCV infection in a subject by administering a pharmaceutical composition comprising the compounds of the present invention.
  • US7728148B2
    申请人:——
    公开号:US7728148B2
    公开(公告)日:2010-06-01
  • US8361958B2
    申请人:——
    公开号:US8361958B2
    公开(公告)日:2013-01-29
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表征谱图

  • 氢谱
    1HNMR
  • 质谱
    MS
  • 碳谱
    13CNMR
  • 红外
    IR
  • 拉曼
    Raman
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cnmr
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  • 峰位数据
  • 峰位匹配
  • 表征信息
Shift(ppm)
Intensity
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Assign
Shift(ppm)
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测试频率
样品用量
溶剂
溶剂用量
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