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4-dodecyloxyphenylacetic acid chloride | 86741-89-1

中文名称
——
中文别名
——
英文名称
4-dodecyloxyphenylacetic acid chloride
英文别名
2-(4-Dodecoxyphenyl)acetyl chloride
4-dodecyloxyphenylacetic acid chloride化学式
CAS
86741-89-1
化学式
C20H31ClO2
mdl
——
分子量
338.918
InChiKey
MSEZKPIJBCYBFW-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:
    432.7±28.0 °C(Predicted)
  • 密度:
    1.007±0.06 g/cm3(Predicted)

计算性质

  • 辛醇/水分配系数(LogP):
    7.9
  • 重原子数:
    23
  • 可旋转键数:
    14
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.65
  • 拓扑面积:
    26.3
  • 氢给体数:
    0
  • 氢受体数:
    2

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:
    4-dodecyloxyphenylacetic acid chloride三氯化铝 盐酸tetraphosphorus decasulfide 作用下, 以 四氯化碳 为溶剂, 反应 11.0h, 生成
    参考文献:
    名称:
    Veber, M.; Fugnitto, R.; Strzelecka, H., Molecular Crystals and Liquid Crystals (1969-1991), 1983, vol. 96, p. 221 - 228
    摘要:
    DOI:
  • 作为产物:
    参考文献:
    名称:
    Analogs of platelet activating factor. 7. Bis-aryl amide and bis-aryl urea receptor antagonists of PAF
    摘要:
    A series of bis-aryl amide (13-57 and 66-81) and bis-aryl urea (58 and 85) antagonists of platelet-activating factor (PAF) was prepared that contain, separating the two aromatic rings, linear amide linkages of the form -(CH2)nCONH- (n = 0-2), -OCH2CONH-, and -(CH2)nNHCO- (n = 0-1), branched amide linkages of the form -(CH2)nN(COR)- (n = 1-3, R = CH3 or n-C3H7), and -N(COCH3)CH2-, and urea linkages of the form -NHCONH- and -CH2N(CONHCH3)-. These compounds were examined for their ability to inhibit PAF-induced platelet aggregation of rabbit platelets. These in vitro data were compared to similar data obtained for a number of known PAF antagonists. The compounds were evaluated in vivo, in the mouse, for their ability to prevent death induced by a lethal challenge of PAF. The relationships between the biological activity and the nature, lipophilicity, and position of substituents of the aromatic rings were studied. Best activity was observed for compounds having linkages of the type -CH2CONH-, -CH2N(COR)-, and -CH2NHCO-. Many of these compounds inhibit PAF-induced platelet aggregation with IC50's under 1 muM.
    DOI:
    10.1021/jm00104a002
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文献信息

  • Analogs of platelet activating factor. 7. Bis-aryl amide and bis-aryl urea receptor antagonists of PAF
    作者:Allan Wissner、Marion L. Carroll、Bernard D. Johnson、Suresh S. Kerwar、Walter C. Pickett、Robert E. Schaub、Lawrence W. Torley、Michael P. Trova、Constance A. Kohler
    DOI:10.1021/jm00104a002
    日期:1992.12
    A series of bis-aryl amide (13-57 and 66-81) and bis-aryl urea (58 and 85) antagonists of platelet-activating factor (PAF) was prepared that contain, separating the two aromatic rings, linear amide linkages of the form -(CH2)nCONH- (n = 0-2), -OCH2CONH-, and -(CH2)nNHCO- (n = 0-1), branched amide linkages of the form -(CH2)nN(COR)- (n = 1-3, R = CH3 or n-C3H7), and -N(COCH3)CH2-, and urea linkages of the form -NHCONH- and -CH2N(CONHCH3)-. These compounds were examined for their ability to inhibit PAF-induced platelet aggregation of rabbit platelets. These in vitro data were compared to similar data obtained for a number of known PAF antagonists. The compounds were evaluated in vivo, in the mouse, for their ability to prevent death induced by a lethal challenge of PAF. The relationships between the biological activity and the nature, lipophilicity, and position of substituents of the aromatic rings were studied. Best activity was observed for compounds having linkages of the type -CH2CONH-, -CH2N(COR)-, and -CH2NHCO-. Many of these compounds inhibit PAF-induced platelet aggregation with IC50's under 1 muM.
  • Veber, M.; Fugnitto, R.; Strzelecka, H., Molecular Crystals and Liquid Crystals (1969-1991), 1983, vol. 96, p. 221 - 228
    作者:Veber, M.、Fugnitto, R.、Strzelecka, H.
    DOI:——
    日期:——
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