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5-(2,5-dimethylphenoxy)-2-methylpentanoic acid chloride | 443924-77-4

中文名称
——
中文别名
——
英文名称
5-(2,5-dimethylphenoxy)-2-methylpentanoic acid chloride
英文别名
——
5-(2,5-dimethylphenoxy)-2-methylpentanoic acid chloride化学式
CAS
443924-77-4
化学式
C14H19ClO2
mdl
——
分子量
254.757
InChiKey
IKLIMNVZHUFAOZ-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):
    3.86
  • 重原子数:
    17.0
  • 可旋转键数:
    6.0
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.5
  • 拓扑面积:
    26.3
  • 氢给体数:
    0.0
  • 氢受体数:
    2.0

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:
    5-(2,5-dimethylphenoxy)-2-methylpentanoic acid chloride正丁基锂过氧化氢,锂盐(1:1) 作用下, 以 四氢呋喃 为溶剂, 反应 1.25h, 生成 (-)-5-(2,5-dimethylphenoxy)-2-methylpentanoic acid
    参考文献:
    名称:
    Synthesis and antiplatelet activity of gemfibrozil chiral analogues
    摘要:
    The chiral analogues of gemfibrozil 5-(2.5-dimethylphenoxy)-2-methylpentanoic acid and 5-(2,5-dimethylphenoxy)-2-ethylpentanoic acid were synthesized in optically active form using (S)-4-(1-methylethyl)-2-oxazolidinone as chiral auxiliary. All compounds inhibit human platelet aggregation. from these data. one can surmise that all tested compounds and gemfibrozil act at the platelet level with different mechanism than that of ASA, even if with a different potency. (C) 2002 Elsevier Science Ltd. All rights reserved.
    DOI:
    10.1016/s0960-894x(02)00021-5
  • 作为产物:
    参考文献:
    名称:
    Synthesis and antiplatelet activity of gemfibrozil chiral analogues
    摘要:
    The chiral analogues of gemfibrozil 5-(2.5-dimethylphenoxy)-2-methylpentanoic acid and 5-(2,5-dimethylphenoxy)-2-ethylpentanoic acid were synthesized in optically active form using (S)-4-(1-methylethyl)-2-oxazolidinone as chiral auxiliary. All compounds inhibit human platelet aggregation. from these data. one can surmise that all tested compounds and gemfibrozil act at the platelet level with different mechanism than that of ASA, even if with a different potency. (C) 2002 Elsevier Science Ltd. All rights reserved.
    DOI:
    10.1016/s0960-894x(02)00021-5
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文献信息

  • Ligand-Promoted Alkylation of C(sp<sup>3</sup>)–H and C(sp<sup>2</sup>)–H Bonds
    作者:Ru-Yi Zhu、Jian He、Xiao-Chen Wang、Jin-Quan Yu
    DOI:10.1021/ja508165a
    日期:2014.9.24
    9-Methylacridine was identified as a generally effective ligand to promote a Pd(II)-catalyzed C(sp3)–H and C(sp2)–H alkylation of simple amides with various alkyl iodides. This alkylation reaction was applied to the preparation of unnatural amino acids and geometrically controlled tri- and tetrasubstituted acrylic acids.
    9-甲基吖啶被确定为一种普遍有效的配体,可促进 Pd(II) 催化的 C(sp3)-H 和 C(sp2)-H 与各种烷基的简单酰胺的烷基化。这种烷基化反应用于制备非天然氨基酸和几何控制的三和四取代丙烯酸
  • Ligand-Enabled Cross-Coupling of C(sp<sup>3</sup>)–H Bonds with Arylsilanes
    作者:Jian He、Ryosuke Takise、Haiyan Fu、Jin-Quan Yu
    DOI:10.1021/jacs.5b00890
    日期:2015.4.15
    Pd(II)-catalyzed cross-coupling of C(sp(3))-H bonds with organosilicon coupling partners has been achieved for the first time. The use of a newly developed quinoline-based ligand is essential for the cross-coupling reactions to proceed.
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